BENZOIC ACID, p-((2,4,6-TRIAMINO-5-PYRIMIDINYL)AZO)-

CAS 2878-04-8 MFCD02878048

化学结构图

2878-04-8
SMILES: Nc1nc(N)c(N=Nc2ccc(C(=O)O)cc2)c(N)n1

化学属性

Mol. FormulaC11H11N7O2
Mol. Weight273.29

别名和识别编码

Wiswesser Line NotationT6N CNJ BZ DZ FZ ENUNR DVQ
Chemical NameBenzoic acid, p-((2,4,6-triamino-5-pyrimidinyl)azo)-
Synonym PY-74 p-((2,4,6-Triamino-5-pyrimidinyl)azo)benzoic acid
CAS Number2878-04-8
Beilstein Registry Number0301734
InChIKeyKJXBXATYKAWGBL-ISLYRVAYSA-N
PubChem Substance ID17893
InChIInChI=1S/C11H11N7O2/c12-8-7(9(13)16-11(14)15-8)18-17-6-3-1-5(2-4-6)10(19)20/h1-4H,(H,19,20)(H6,12,13,14,15,16)
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安全信息

RTECSDH7098000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 7,7,1959

系列性分类

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