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

Modify Date: 2025-11-11 12:11:17

2-((2-((Methylamino)methyl)phenyl)thio)-1,4-benzenediol (Z)-2-butenedi oate (1:1) (salt) structure	Common Name	2-((2-((Methylamino)methyl)phenyl)thio)-1,4-benzenediol (Z)-2-butenedi oate (1:1) (salt)
	CAS Number	127906-41-6	Molecular Weight	377.41200
	Density	N/A	Boiling Point	418.9ºC at 760 mmHg
	Molecular Formula	C₁₈H₁₉NO₆S	Melting Point	N/A
	MSDS	N/A	Flash Point	207.1ºC

Name	(E)-but-2-enedioic acid,2-[2-(methylaminomethyl)phenyl]sulfanylbenzene-1,4-diol

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

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

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