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AG00IABC
58-55-9 | Theophylline
AG00IABC
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| CAS Number | 58-55-9 |
| Catalog Number | AG00IABC(AGN-PC-0WAFD2) |
| Chemical Name | Theophylline |
| EC Number | 200-385-7 |
| IUPAC Name | 1,3-dimethyl-7H-purine-2,6-dione |
| InChI | InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9) |
| InChI Key | ZFXYFBGIUFBOJW-UHFFFAOYSA-N |
| MDL Number | MFCD00079619 |
| Molecular Formula | C7H8N4O2 |
| Molecular Weight | 180.1640 |
| RTECS Number | XH3850000 |
| SMILES | CN1C(=O)N(C=2N=CNC2C1=O)C |
| UN Number | 1544 |
| UNII | 0I55128JYK |
| Synonyms | 1,3 Dimethylxanthine,
1,3-Dimethylxanthine,
3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione,
Accurbron,
Aerobin,
Aerolate,
Afonilum Retard,
Anhydrous, Theophylline,
Aquaphyllin,
Armophylline,
Bronchoparat,
Bronkodyl,
Constant T,
Constant-T,
ConstantT,
ct, theo von,
Elixophyllin,
Euphylong,
Glycinate, Theophylline Sodium,
Glycine Theophyllinate,
Lodrane,
Monospan,
Nuelin,
Nuelin S.A.,
Quibron T SR,
Quibron T-SR,
Quibron TSR,
Slo Phyllin,
Slo-Phyllin,
SloPhyllin,
Sodium Glycinate, Theophylline,
Somophyllin T,
Somophyllin-T,
SomophyllinT,
Sustaire,
Synophylate,
Theo 24,
Theo Dur,
theo von ct,
Theo-24,
Theo-Dur,
Theo24,
Theobid,
Theocin,
Theoconfin Continuous,
Theodur,
Theolair,
Theolix,
Theon,
Theonite,
Theopek,
Theophyllinate, Glycine,
Theophylline,
Theophylline Anhydrous,
Theophylline Sodium Glycinate,
Theospan,
Theostat,
Theovent,
Uniphyl,
Uniphyllin,
Uniphylline,
von ct, theo,
theophylline,
58-55-9,
1,3-Dimethylxanthine,
Elixophyllin,
Theophyllin,
Theolair,
Nuelin,
Theophylline anhydrous,
Respbid,
Theocin,
Theo-dur,
Elixophylline,
Pseudotheophylline,
Lanophyllin,
Theovent,
Uniphyl,
Slo-phyllin,
Accurbron,
Armophylline,
Bronkodyl,
Doraphyllin,
Liquophylline,
Maphylline,
Medaphyllin,
Optiphyllin,
Parkophyllin,
Synophylate,
Teofyllamin,
Theacitin,
Theocontin,
Uniphyllin,
Xantivent,
Aerolate,
Elixicon,
Solosin,
Teolair,
Theobid,
Theofol,
Theograd,
Theolix,
Elixex,
Acet-theocin,
Slo-bid,
Theophyl-225,
Aerolate III,
Duraphyl,
Euphylong,
Sustaire,
Austyn,
Somophyllin-t,
Constant-T,
Teofilina,
Theochron,
Xanthium,
Asmax,
Quibron T/SR,
Theal tablets,
Somophyllin-DF,
Bronkodyl SR,
Theoclair-SR,
Theoclear LA,
Spophyllin retard,
Choledyl SA,
Quibron-T,
Theoclear 80,
Aquaphyllin,
Aerobin,
Tefamin,
Theo-11,
Theo-24,
Theodur,
Theopek,
Theospan,
Theostat 80,
Synophylate-L.A. Cenules,
Theophylline, anhydrous,
Theo-Dur-Sprinkle,
3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione,
LaBID,
Diffumal,
Elixomin,
Theolixir,
Theophyl,
Theophyline,
Theostat,
Theodel,
Unifyl,
LASMA,
Elixophyllin SR,
Theophylline-SR,
Pro-vent,
Somophyllin-CRT,
Aerolate SR,
Theolair-SR,
Theophyl-SR,
1,3-dimethyl-7H-purine-2,6-dione,
Theona P,
Uni-Dur,
Theoclear-80,
Quibron-T/SR,
T-Phyl,
Euphylline,
Theoclear-200,
Teofilina [Polish],
Labophylline,
Bronkotabs,
Mudrane,
Pulmidur,
Teonova,
Theokin,
1,3-Dimethyl-3,7-dihydro-1H-purine-2,6-dione,
Asbron,
Hylate,
Theo-Organidin,
GS 2591A,
Nuelin SA,
Bronchodid Duracap,
Theobid Jr.,
Theoclear L.A.-130,
Uniphyllin continus,
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-,
Xanthine, 1,3-dimethyl-,
Dimethylxanthine,
NSC 2066,
Teocen 200,
X 115,
Quadrinal,
Theal tabl.,
1,3-dimethyl-1H-purine-2,6(3H,7H)-dione,
1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione,
UNII-0I55128JYK,
CCRIS 4729,
HSDB 3399,
2,6-Dihydroxy-1,3-dimethylpurine,
Purine-2,6(1H,3H)-dione, 1,3-dimethyl-,
EINECS 200-385-7,
CHEMBL190,
Theophylline [USP],
C7H8N4O2,
1H-Purine-2,6-dione, 3,9-dihydro-1,3-dimethyl-,
THEOBID JR,
AI3-50216,
MLS000069390,
Cetraphylline,
Chronophyllin,
Duraphyllin,
Etheophyl,
1,3-dimethyl-1H-purine-2,6(3H,9H)-dione,
CHEBI:28177,
ZFXYFBGIUFBOJW-UHFFFAOYSA-N,
0I55128JYK,
Constant T,
Euphyllin,
1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurine,
MFCD00079619,
NCGC00018117-07,
NCGC00018117-17,
Uniphylline,
Afonilm,
Bilordyl,
Egifilin,
Physpan,
SMR000058537,
Theonite,
Afonilum Retard,
Somophyllin T,
DSSTox_CID_1336,
1,3-dimethyl-1,3,7-trihydropurine-2,6-dione,
DSSTox_RID_76090,
DSSTox_GSID_21336,
Quibron T-SR,
75448-53-2,
Theophylline, 99+%, anhydrous,
Bronchoretard,
Theo 24,
Afonilum,
Asmalix,
Respicur,
Talotren,
Teosona,
Theoclear,
Theodrip,
Theoplus,
Theotard,
Unilong,
Respid,
Tesona,
Pulmo-Timelets,
Theobid Duracap,
Elixophyllin(e),
Somophyllin CRT,
Quibron T,
Theo-Nite,
CAS-58-55-9,
Theodur Dry Syrup,
Nuelin S.A,
Telb-DS,
Theo-DS,
Theolair (TN),
Elixophyllin (TN),
Uniphyl (TN),
Quibron-t (TN),
Theoconfin Continuous,
Theodur G (TN),
Glycine Theophyllinate,
1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione,
SR-01000075195,
Theo-24 (TN),
Telbans,
Physpa,
Unicontin CR,
4eoh,
Aescin-IIA,
Telbans Dry Syrup,
PubChem9695,
theophylline solu-tion,
component of Primatene,
Xanthine,3-dimethyl-,
Opera_ID_76,
Spectrum_001038,
Theophylline (JP17),
2a3a,
Theophylline aminoacetate,
Theophylline (anhydrous),
Prestwick0_000820,
Prestwick0_000873,
Prestwick1_000820,
Prestwick1_000873,
Prestwick2_000820,
Prestwick2_000873,
Prestwick3_000820,
Prestwick3_000873,
Spectrum2_000842,
Spectrum3_000672,
Spectrum4_000353,
Spectrum5_001232,
8-(2-Furyl)theophylline,
UPCMLD-DP123,
component of Theo-Organidin,
EC 200-385-7,
AC1L1D1F,
SCHEMBL4915,
Theophylline Anhydrous,(S),
Theophylline Anhydrous, USP,
Lopac0_000014,
BSPBio_000719,
BSPBio_000945,
BSPBio_002363,
component of Dicurin Procaine,
GTPL413,
KBioGR_000785,
KBioSS_001518,
KSC491S8L,
MLS002152943,
MLS002153487,
MLS004491910,
MLS006011970,
ARONIS25346,
BIDD:ER0557,
BIDD:GT0151,
DivK1c_000203,
SPECTRUM1500568,
SPBio_000823,
SPBio_002640,
SPBio_002866,
BPBio1_000791,
BPBio1_001041,
SCHEMBL8312163,
component of Tedral (Salt/Mix),
DTXSID5021336,
UPCMLD-DP123:001,
BCBcMAP01_000071,
BDBM10847,
BDBM82053,
component of Quibron (Salt/Mix),
CTK3J1985,
HMS500K05,
KBio1_000203,
KBio2_001518,
KBio2_004086,
KBio2_006654,
KBio3_001583,
NSC2066,
component of Hecadrol (Salt/Mix),
NINDS_000203,
HMS1921E03,
HMS2089A06,
HMS2092M05,
HMS2233E16,
HMS3259O06,
HMS3369N14,
Pharmakon1600-01500568,
component of Primatene (Salt/Mix),
component of Bronkotabs (Salt/Mix),
HY-B0809,
NSC-2066,
Theophylline 1.0 mg/ml in Methanol,
Theophylline, >=99.0% (HPLC),
Tox21_110827,
Tox21_202375,
Tox21_300028,
BBL023514,
CCG-20301,
LS-241,
NSC757346,
PDSP1_001018,
PDSP1_001234,
PDSP2_001002,
PDSP2_001218,
STK397040,
Theophylline (1,3-dimethylxanthine),
ZINC18043251,
AKOS000120961,
AKOS005434016,
component of Quibron Plus (Salt/Mix),
Tox21_110827_1,
component of Quibron-T/SR (Salt/Mix),
component of Theo-organdin (Salt/Mix),
component of Theolair plus (Salt/Mix),
CS-4158,
DB00277,
MCULE-8236489917,
NC00542,
NE11194,
NSC-757346,
Purine-2,3H)-dione, 1,3-dimethyl-,
RP24142,
SDCCGMLS-0066620.P001,
component of Theo-Organidin (Salt/Mix),
IDI1_000203,
KS-000010T0,
KS-0000477R,
SMP1_000291,
component of Slo-phyllin GG (Salt/Mix),
NCGC00018117-01,
NCGC00018117-02,
NCGC00018117-03,
NCGC00018117-04,
NCGC00018117-05,
NCGC00018117-06,
NCGC00018117-08,
NCGC00018117-09,
NCGC00018117-10,
NCGC00018117-11,
NCGC00018117-12,
NCGC00018117-13,
NCGC00018117-14,
NCGC00018117-15,
NCGC00018117-16,
NCGC00018117-18,
NCGC00018117-19,
NCGC00018117-20,
NCGC00018117-23,
NCGC00022112-03,
NCGC00022112-04,
NCGC00022112-05,
NCGC00022112-07,
NCGC00022112-08,
NCGC00022112-09,
NCGC00022112-10,
NCGC00022112-11,
NCGC00022112-12,
NCGC00254040-01,
NCGC00259924-01,
WLN: T56 BM DN FNVNVJ F1 H1,
AC-20328,
AN-23602,
component of Dicurin Procaine (Salt/Mix),
CPD000058537,
NCI60_001736,
SAM002554935,
SC-05534,
SC-95891,
SMR003435989,
ST024762,
Theophylline, anhydrous, >=99%, powder,
component of Primatene tablets (Salt/Mix),
Purine,6(1H,3H)-dione, 1,3-dimethyl-,
SBI-0050003.P004,
AB1009249,
component of Mudrane GG elixir (Salt/Mix),
DB-053224,
1H-Purine-2, 3,7-dihydro-1,3-dimethyl-,
AB00052106,
FT-0631259,
N1442,
6461-EP1441224A2,
6461-EP2272835A1,
6461-EP2272841A1,
6461-EP2272844A1,
6461-EP2280006A1,
6461-EP2281813A1,
6461-EP2281815A1,
6461-EP2286811A1,
6461-EP2295434A2,
6461-EP2298305A1,
6461-EP2301933A1,
6461-EP2301936A1,
6461-EP2301937A1,
6461-EP2305219A1,
6461-EP2305640A2,
6461-EP2308562A2,
6461-EP2311827A1,
6461-EP2314590A1,
C07130,
D00371,
83377-EP2371823A1,
AB00052106-20,
AB00052106-22,
AB00052106-23,
AB00052106_24,
AB00052106_25,
AB00052106_26,
3,7-dihydro-1,3-dimethyl-1H- purine-2,6-dione,
L000595,
1,3-Dimethyl-3,7-dihydro-1H-purine-2,6-dione #,
Q-201819,
SR-01000075195-1,
SR-01000075195-3,
SR-01000075195-5,
1,3-Dimethyl-6-hydroxy-1,3-dihydro-2H-purin-2-one,
BRD-K97799481-001-02-0,
BRD-K97799481-001-12-9,
BRD-K97799481-002-03-6,
I14-16783,
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, mo,
F2173-0145,
Z271004650,
A3133D49-AAB6-49A1-B60B-B5198F327D3F,
Theophylline, British Pharmacopoeia (BP) Reference Standard,
Theophylline, European Pharmacopoeia (EP) Reference Standard,
(8alpha, 9S)-10,11-Dihydro-6'-methoxycinchonan-9-amine trihydrochloride, min. 90%,
Theophylline melting point standard, United States Pharmacopeia (USP) Reference Standard,
Theophylline solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material,
Theophylline, Pharmaceutical Secondary Standard; Certified Reference Material,
1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurine; 1,3-Dimethylxanthine; 3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione,
111079-49-3,
InChI=1/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9,
Theophylline melting point standard, Pharmaceutical Secondary Standard; Certified Reference Material,
Theophylline, certified reference material, United States Pharmacopeia (USP) Reference Standard,
aminophylline,
Diphyllin,
Theon,
Dyspne-Inhal,
Bronchoparat,
Liquorice,
Monospan,
Lodrane,
Quibron,
SomophyllinT,
SloPhyllin,
ConstantT,
Elan,
throphylline,
Slo Phyllin,
theo von ct,
Aminophyllin,
Brochoretard,
Guaifylline,
Insanovin,
Apnecut,
Theo Dur,
Theo-Sav,
theophyllin-,
Quibron TSR,
ct, theo von,
von ct, theo,
Quibron T SR,
Telbans DrySyrup,
Theodur G,
Nuelin S.A.,
Theo24,
Controfilina 200,
1,3 Dimethylxanthine,
component of Tedral,
1H-purine-2,6-dione,
Theophylline 454g,
1,3-dimetilxantina,
13-Dimethylxanthine,
component of Quibron,
component of Hecadrol,
Choline theophyllinate,
Theophylline (8CI),
Aminophylline dihydrate,
Theophylline-[8-3H,
AEROLATE JR,
component of Bronkotabs,
Anhydrous, Theophylline,
Theophyllinate, Glycine,
Theophylline (JP15),
Theophylline monohydrate,
component of Quibron Plus,
THEOCLEAR-100,
D0F8RA,
THEOPHYLLINE SODIUM GLYCINATE,
Glycinate, Theophylline Sodium,
Sodium Glycinate, Theophylline,
THEOCLEAR L.A.-260,
CID2153,
C7-H8-N4-O2,
c1152,
ACN-046916,
CS-O-30795,
Theophylline, 98% - 100G 100g,
T0179,
Theophylline anhydrous 99% extra pure 100gm,
D013806,
1H-purina-2,6-diona, 3,7-dihidro-1,3-dimetil-,
1H-purina-2,6-diona, 3,9-dihidro-1,3-dimetil-,
1H-Purine-26-dione37-dihydro-13-dimethyl-(9CI),
THEOPHYLLINE AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE IN DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.2% AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.4% AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.04% AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.08% AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.16% AND DEXTROSE 5% IN PLASTIC CONTAINER,
THEOPHYLLINE 0.32% AND DEXTROSE 5% IN PLASTIC CONTAINER,
49746-06-7,
TEP,
158732-55-9,
317-34-0,
46155-90-2,
5967-84-0,
|
| Complexity | 267 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.167g/mol |
| Monoisotopic Mass | 180.065g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 69.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
| Hazard statements | H301 |
| Precuationary statements | P301+P310 |
| Siginal words | |
Certificate of Analysis
Lot Number
Product Recommendations
CERTIFICATE OF ANALYSIS
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
| Quantity: |
Analysis Data:
| Test: | Result: |
Conclusion: The above product meets the specifications of Angene.
Analyst:Chase
Date:
Reviewed by:Jessie
Date:
Angene International Limited