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AG0038PH
50-44-2 | 6-Mercaptopurine
AG0038PH
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| CAS Number | 50-44-2 |
| Catalog Number | AG0038PH(AGN-PC-0OBCLT) |
| Chemical Name | 6-Mercaptopurine |
| EC Number | 200-037-4 |
| IUPAC Name | 3,7-dihydropurine-6-thione |
| InChI | InChI=1S/C5H4N4S/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10) |
| InChI Key | GLVAUDGFNGKCSF-UHFFFAOYSA-N |
| MDL Number | MFCD03854445 |
| Molecular Formula | C5H4N4S |
| Molecular Weight | 152.1771 |
| SMILES | SC1=C2NC=NC2=NC=N1 |
| UNII | PKK6MUZ20G |
| Synonyms | 1,7-Dihydro-6H-purine-6-thione,
6 Mercaptopurine,
6 Mercaptopurine Monohydrate,
6 Thiohypoxanthine,
6 Thiopurine,
6-Mercaptopurine,
6-Mercaptopurine Monohydrate,
6-Thiohypoxanthine,
6-Thiopurine,
6H-Purine-6-thione, 1,7-dihydro-,
BW 57 323H,
BW 57-323H,
BW 57323H,
Leupurin,
Mecaptopurine Anhydrous,
Mercaptopurina Wellcome,
Mercaptopurine,
Puri-Nethol,
Purimethol,
Purinethol,
6-Mercaptopurine,
mercaptopurine,
50-44-2,
Mercapurin,
Purinethol,
6-Thiopurine,
Leukerin,
Leupurin,
Mercaleukin,
6-Thioxopurine,
Puri-Nethol,
Ismipur,
Mern,
6-Thiohypoxanthine,
6-Mercaptopurin,
6-Purinethiol,
7H-purine-6-thiol,
Purimethol,
Purinethiol,
6-MP,
Purine-6-thiol,
1,9-dihydro-6H-purine-6-thione,
3H-Purine-6-thiol,
6 MP,
9H-Purine-6-thiol,
Mercaleukim,
Mercaptopurina,
Mercaptopurinum,
Hypoxanthine, thio-,
Mercaptopurine (6-MP),
3,7-dihydropurine-6-thione,
1,7-Dihydro-6H-purine-6-thione,
Mercaptopurin,
Merkaptopuryna,
6H-Purine-6-thione, 1,7-dihydro-,
Xaluprine,
6-Merkaptopurin,
Purine, 6-mercapto-,
9H-Purine-6(1H)-thione,
Mercaptopurine anhydrous,
Purine-6(1H)-thione,
Mercaptopurine (VAN),
NCI-C04886,
Mercaptopurin [German],
Merkaptopuryna [Polish],
7-Mercapto-1,3,4,6-tetrazaindene,
6-Merkaptopurin [Czech],
Mercaptopurine (anhydrous),
1H-Purine, 6-mercapto-,
NSC 755,
Mercaptopurinum [INN-Latin],
Mercaptopurina [INN-Spanish],
U-4748,
NSC-755,
UNII-PKK6MUZ20G,
C5H4N4S,
CCRIS 2761,
NSC755,
HSDB 3235,
Purinethol (TN),
EINECS 200-037-4,
PKK6MUZ20G,
1,9-dihydropurine-6-thione,
CHEBI:2208,
GLVAUDGFNGKCSF-UHFFFAOYSA-N,
DSSTox_CID_810,
DSSTox_RID_75801,
DSSTox_GSID_20810,
157930-13-7,
157930-14-8,
Purixan,
thiohypoxanthine,
Leupu rin,
CAS-50-44-2,
SMR000544948,
Mercaptopurine, 6-,
Mercaptopurine (INN),
SR-05000001925,
NCIMech_000025,
1H-purine-6(7H)-thione,
9H-Purin-6-yl hydrosulfide,
Mercaptopurine;,
Mercaptopurine [USAN:USP:INN],
6-Mercaptoadenine,
PubChem9680,
Spectrum_000921,
ACMC-1AUNA,
Spectrum2_000060,
Spectrum3_000491,
Spectrum4_000857,
Spectrum5_000950,
M0063,
H-Purine-6(1H)-thione,
Leukerin, 99% - Carc,
AC1LDI73,
SCHEMBL3893,
CHEMBL1425,
BSPBio_001981,
KBioGR_001493,
KBioGR_002363,
KBioSS_001401,
KBioSS_002366,
AG-670/31547064,
KSC270A9L,
MLS001066623,
MLS001304020,
MLS001304953,
MLS006011869,
ARONIS27054,
DivK1c_000493,
SPECTRUM1500387,
SPBio_000219,
GTPL7226,
SCHEMBL2790086,
7H-Purin-6-yl hydrosulfide #,
DTXSID0020810,
SCHEMBL12683725,
CHEBI:50667,
CHEBI:94796,
CTK1H0095,
CTK8A7797,
HMS501I15,
KBio1_000493,
KBio2_001401,
KBio2_002363,
KBio2_003969,
KBio2_004931,
KBio2_006537,
KBio2_007499,
KBio3_001481,
KBio3_002842,
7-Mercapto-1,4,6-tetrazaindene,
cMAP_000033,
NINDS_000493,
Purinethol;6-mercaptopurine;6-MP,
3,7-dihydro-6H-purine-6-thione,
6,7-dihydro-3H-purine-6-thione,
HMS1920L07,
HMS2091B20,
HMS2236L06,
HMS3259N03,
HMS3369M05,
HMS3651G07,
HMS3713N10,
Pharmakon1600-01500387,
ACT11542,
EBD16256,
KS-000048JV,
ZINC4658290,
Tox21_111158,
Tox21_202591,
6450AJ,
ANW-30999,
ANW-57555,
BBL033743,
BDBM50423778,
CCG-35344,
CCG-39915,
EBD540779,
LS-141,
MFCD00233552,
NSC759614,
s1305,
SBB037953,
STK727062,
STL257085,
6-Mercaptopurine, analytical standard,
WLN: T56 BM DN FN HNJ ISH,
AKOS000170222,
AKOS000275858,
AKOS005224624,
AKOS008901311,
AKOS016903205,
Tox21_111158_1,
AM81386,
AN-6979,
CM-1232,
CS-1499,
DB01033,
LS20858,
MCULE-4811219863,
NC00613,
NSC-759614,
RP21622,
RTR-021065,
IDI1_000493,
NCGC00091641-02,
NCGC00091641-03,
NCGC00091641-04,
NCGC00094717-01,
NCGC00094717-02,
NCGC00094717-03,
NCGC00094717-05,
NCGC00094717-06,
NCGC00188973-01,
NCGC00260139-01,
AC-11464,
AJ-51833,
AN-24375,
AS-13109,
BC202313,
CPD000544948,
H348,
HY-13677,
NCI60_041653,
SAM002589937,
SC-04873,
SMR004703503,
ST086505,
ST086506,
SBI-0051437.P004,
AB0013000,
AB0119973,
AB2000041,
DB-026398,
TR-021065,
4CH-021382,
BB 0241023,
FT-0083571,
FT-0621175,
SW199090-2,
EN300-61517,
1766-EP2270008A1,
1766-EP2272827A1,
1766-EP2272832A1,
1766-EP2277876A1,
1766-EP2292614A1,
1766-EP2292617A1,
1766-EP2295409A1,
1766-EP2295426A1,
1766-EP2295427A1,
1766-EP2298768A1,
1766-EP2298778A1,
1766-EP2308833A2,
1766-EP2308855A1,
1766-EP2308861A1,
1766-EP2314590A1,
1766-EP2316834A1,
1766-EP2374454A1,
50M442,
C01756,
C02380,
D04931,
W-5114,
15150-EP2272827A1,
15150-EP2275420A1,
15150-EP2295055A2,
15150-EP2295416A2,
15150-EP2298748A2,
15150-EP2298764A1,
15150-EP2298765A1,
15150-EP2305642A2,
15150-EP2305679A1,
15150-EP2308833A2,
15150-EP2311453A1,
15150-EP2311825A1,
15150-EP2311840A1,
15150-EP2311842A2,
15150-EP2316832A1,
15150-EP2316833A1,
21414-EP2270006A1,
21414-EP2270014A1,
21414-EP2272509A1,
21414-EP2272847A1,
21414-EP2275413A1,
21414-EP2277874A1,
21414-EP2284158A1,
21414-EP2287156A1,
21414-EP2287159A1,
21414-EP2295439A1,
21414-EP2311818A1,
21414-EP2314295A1,
AB00171799_05,
AB00641894-03,
AB00641894-04,
AB00641894_05,
AB00876276-13,
233D552,
462M721,
599M524,
A828129,
I14-1716,
SR-05000001925-1,
SR-05000001925-2,
W-105961,
purine antimetabolite: inhibits nucleic acid replication,
1,9-Dihydropurine-6-thione DISCONTINUED, see M225450,
Leukeran,
Purine-6-thione,
Thiopurine,
6 Thiopurine,
6 Mercaptopurine,
Loulla,
mercaptopurin-,
1H-Purine-6(9H)-thione,
6 Thiohypoxanthine,
Puri Nethol,
Mercaptopurina Wellcome,
Mercaptopurine Monohydrate,
Mercaptopurine hydrate,
Mecaptopurine Anhydrous,
Leukerin, 99%-Carc,
2-Bromo-6-nitroaniline,
6 Mercaptopurine Monohydrate,
C5H4N4S.Na,
D09UZO,
6-MERCAPTOPURINE MONOHYDRATE,
Mercaptopurine [USAN:USP],
Purine-6-thiol, monohydrate,
6-Mercaptopurine sodium salt,
BW 57323H,
C5-H4-N4-S.Na,
Mercaptopurine (Purine analog),
Purine-6-thiol, monosodium salt,
6H-Purine-6-thione,7-dihydro-,
C5-H4-N4-S,
BW 57 323H,
BW 57-323H,
Wellcome Brand of 6 Mercaptopurine,
Wellcome Brand of 6-Mercaptopurine,
CID667490,
CS-O-30642,
Glaxo Wellcome Brand of 6 Mercaptopurine,
Glaxo Wellcome Brand of 6-Mercaptopurine,
NCGC00091641-01,
6112-76-1,
GlaxoSmithKline Brand of 6 Mercaptopurine,
GlaxoSmithKline Brand of 6-Mercaptopurine,
A2355,
A10568,
D015122,
6H-Purine-6-thione, 1,3-dihydro-, monosodium salt,
Purinethol, 6-mercaptopurine, 6-MP, Mercaptopurine,
Purineantimetabolite: inhibits nucleic acid replication,
MP,
PM6,
1194-62-3,
6MP,
|
| Complexity | 190 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.016g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.175g/mol |
| Monoisotopic Mass | 152.016g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 85.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
| Hazard Class | 6.1 |
| Hazard statements | H302-H315-H319-H335 |
| Packing Group | Ⅲ |
| Precautionary statements | P261-P280-P301+P312-P302+P352-P305+P351+P338 |
| UN Code | UN 2811 |
Certificate of Analysis
Lot Number
Related Research Chemicals
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