2-((2-((Methylamino)methyl)phenyl)thio)-1,4-benzenediol (Z)-2-butenedi oate (1:1) (salt)

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Names

[ CAS No. ]:
127906-41-6

[ Name ]:
2-((2-((Methylamino)methyl)phenyl)thio)-1,4-benzenediol (Z)-2-butenedi oate (1:1) (salt)

Chemical & Physical Properties

[ Boiling Point ]:
418.9ºC at 760 mmHg

[ Molecular Formula ]:
C18H19NO6S

[ Molecular Weight ]:
377.41200

[ Flash Point ]:
207.1ºC

[ Exact Mass ]:
377.09300

[ PSA ]:
152.39000

[ LogP ]:
3.07110

[ Vapour Pressure ]:
1.3E-07mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CZ9019400
CAS REGISTRY NUMBER :
127906-41-6
LAST UPDATED :
199207
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H15-N-O2-S.C4-H4-O4
MOLECULAR WEIGHT :
377.44

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
611 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 54,3294,1989

Related Compounds

  • 2-chloro-8-(methoxymethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
  • 2-chloro-8-(methoxymethyl)-3-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
  • 2-chloro-8-(methoxymethyl)-3-(propan-2-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
  • 2-chloro-8-(2-methoxyethyl)-3-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
  • 2-chloro-8-(2-methoxyethyl)-3-(2-methylpropyl)-4H-pyrido[1,2-a]pyrimidin-4-one
  • 1-[2-cyclopropyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoyl]pyrrolidine-3-carboxylic acid
  • 2-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methoxy-N-(prop-2-en-1-yl)propanamido]acetic acid
  • tert-butyl N-[2-fluoro-5-(propan-2-yloxy)pyridin-4-yl]carbamate
  • methyl 4-(aminomethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-3-carboxylate
  • 1-[3-fluoro-4-(4-methanesulfonyl-1H-pyrazol-1-yl)phenyl]ethan-1-amine
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