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| CAS Number | 42835-25-6 |
| Catalog Number | AG003QLL(AGN-PC-0WAMN8) |
| Chemical Name | Flumequine |
| EC Number | 255-962-6 |
| IUPAC Name | 7-fluoro-12-methyl-4-oxo-1-azatricyclo[7.3.1.05,13]trideca-2,5,7,9(13)-tetraene-3-carboxylic acid |
| InChI | InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19) |
| InChI Key | DPSPPJIUMHPXMA-UHFFFAOYSA-N |
| MDL Number | MFCD00079298 |
| Molecular Formula | C14H12FNO3 |
| Molecular Weight | 261.2484 |
| NSC Number | 757806 |
| SMILES | CC1CCC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2 |
| Synonyms | Apurone,
flumequine,
R 802,
R-802,
flumequine,
42835-25-6,
Flumigal,
Apurone,
9-Fluoro-5-methyl-1-oxo-1,5,6,7-tetrahydropyrido[3,2,1-ij]quinoline-2-carboxylic acid,
Flumequinum,
Flumequino,
Flumiquil,
Flumisol,
Imequyl,
Flumix,
R 802 (bactericide),
Flumequinum [INN-Latin],
Flumequino [INN-Spanish],
HSDB 7034,
R 802,
EINECS 255-962-6,
MLS000069546,
CHEBI:85269,
DPSPPJIUMHPXMA-UHFFFAOYSA-N,
MFCD00079298,
9-fluoro-6,7-dihydro-5-methyl-1-oxo-1h,5h-benzo[ij]quinolizine-2-carboxylic acid,
NCGC00018211-03,
AK-27078,
SMR000058826,
1H,5H-Benzo(ij)quinolizine-2-carboxylic acid, 9-fluoro-6,7-dihydro-5-methyl-1-oxo-,
9-Fluoro-6,7-dihydro-5-methyl-1-oxo-1H,5H-benzo(ij)quinolizine-2-carboxylic acid,
DSSTox_CID_25623,
DSSTox_RID_81008,
DSSTox_GSID_45623,
Q-201123,
6,7-Dihydro-9-fluoro-5-methyl-1-oxo-1H,5H-quinolizine-2-carboxylic acid,
1H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 9-fluoro-6,7-dihydro-5-methyl-1-oxo-,
9-Fluoro-5-methyl-1-oxo-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acid,
SR-01000000130,
Fantacin,
Flumequine [USAN:BAN:INN],
Flumequine [USAN:INN:BAN],
(RS)-9-Fluoro-5-methyl-1-oxo-6,7-dihydro-1H,5H-benzo[i,j]quinolizine-2-carboxylic acid,
Prestwick_603,
Apurone (TN),
CAS-42835-25-6,
Spectrum_000367,
AC1L1FSH,
Flumequine (USAN/INN),
Opera_ID_1399,
Prestwick0_000204,
Prestwick1_000204,
Prestwick2_000204,
Prestwick3_000204,
Spectrum2_001200,
Spectrum3_001417,
Spectrum4_000826,
Spectrum5_001532,
R-802,
SCHEMBL49829,
BSPBio_000187,
BSPBio_003094,
KBioGR_001371,
KBioSS_000847,
MLS001074120,
DivK1c_000089,
SPECTRUM1500992,
SPBio_001279,
SPBio_002108,
BPBio1_000207,
CHEMBL370252,
DTXSID5045623,
CHEBI:94431,
CTK1D6186,
HMS500E11,
KBio1_000089,
KBio2_000847,
KBio2_003415,
KBio2_005983,
KBio3_002314,
NINDS_000089,
HMS1568J09,
HMS1921O10,
HMS2092O08,
HMS2095J09,
HMS2230F14,
HMS3373O15,
HMS3652K09,
HMS3712J09,
Pharmakon1600-01500992,
EBD52299,
HY-B0526,
KS-00000G9K,
Tox21_110840,
ANW-59991,
CCG-40315,
GA3854,
NSC757806,
s3181,
SBB012470,
fluoro-methyl-oxo-[?]carboxylic acid,
6,7-dihydro-9-fluoro-5-methyl-1-oxo- 1H,5H-quinolizine-2-carboxylic acid,
AKOS015904879,
Tox21_110840_1,
AC-1284,
API0002722,
CS-2747,
DB08972,
HS-0096,
MCULE-1576355150,
NSC-757806,
IDI1_000089,
NCGC00018211-02,
NCGC00018211-04,
NCGC00018211-05,
NCGC00018211-06,
NCGC00018211-10,
NCGC00089803-02,
NCGC00089803-03,
NCGC00178300-01,
NCGC00178300-02,
AN-15109,
BC204036,
CC-28464,
LS-40210,
ST072199,
SBI-0051623.P002,
AB1009285,
AX8130483,
TR-016689,
F0832,
FT-0626439,
ST24045868,
SW196774-3,
D02302,
Flumequine, VETRANAL(TM), analytical standard,
AB00052187_17,
AB00052187_18,
835F256,
C-16315,
SR-01000000130-2,
SR-01000000130-4,
BRD-A69777949-001-05-1,
BRD-A69777949-001-15-0,
1H-Benzimidazol-2-amine, 1-[(4-methylphenyl)sulfonyl]-,
Flumequine, European Pharmacopoeia (EP) Reference Standard,
42835-25-6,143984-63-8,42835-68-7(sodiumsalt),
1H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 9-fluoro-6,7-dihydro-5-methyl-1-oxo,
1H,5H-Benzo[ij]quinolizine-2-carboxylicacid, 9-fluoro-6,7-dihydro-5-methyl-1-oxo-,
6,7Dihydro-9-fluoro-5-methyl-1-oxo-1H,5H-benzo[ij]-quinolizine-2-carboxylic acid,
9-Fluoro-1,5,6,7-tetrahydro-5-methyl-1-oxopyrido[3,2,1-ij]quinoline-2-carboxylic Acid,
7-fluoro-12-methyl-4-oxo-1-azatricyclo[7.3.1.0;{5,13}]trideca-2,5,7,9(13)-tetraene-3-carboxylic acid,
null,
quinolone,
UNII-UVG8VSP2SJ,
(+/-)-Flumequine,
UVG8VSP2SJ,
C14H12FNO3,
Flumequine, 98% - 1G 1g,
CID3374,
ML130,
C14-H12-F-N-O3,
C012976,
FLM,
799264-47-4,
|
| Complexity | 462 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.252g/mol |
| Monoisotopic Mass | 261.08g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
| Symbol: | |
| Hazard Class | |
| Hazard statements | H302-H315-H319-H335 |
| Packing Group | |
| Precautionary statements | P261-P305+P351+P338 |
| UN Code |
| Chemical Name: | Batch Number: | |
| Chemical Structure: | CAS Registry No: | |
| Product ID: | ||
| Manufacture Date: | ||
| Storage Temperature: | ||
| Formula: | ||
| Molecular Weight: | ||
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| Test: | Result: |

