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

{1-[(2-Methylphenyl)methyl]cyclopropyl}methanol
3-(4-Methoxyphenyl)-3-methylpyrrolidine
3-Methoxy-2,2-dimethylcyclobutan-1-ol
Propanamide, N,N-diethyl-2-[[2-methyl-3-(methylthio)propyl]amino]-
2-Bromo-5-(4-chlorophenyl)cyclohexane-1,3-dione
3-Chloro-N-phenylbenzeneethanamine
2-(3-Chlorophenyl)-2-(2,2,2-trifluoroethoxy)ethanamine
{1-[(3,4-Dichlorophenyl)methyl]cyclopropyl}methanol
4,4,4-Trifluoro-3-(quinolin-6-yl)butanoic acid
4-(1-ethyl-1H-imidazol-2-yl)piperidine

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