Benzeneethanamine, 3,4-dimethoxy-N-(4,5-dimethoxy-2-nitrophenyl)-

Modify Date: 2024-02-02 13:05:26

Benzeneethanamine, 3,4-dimethoxy-N-(4,5-dimethoxy-2-nitrophenyl)- structure	Common Name	Benzeneethanamine, 3,4-dimethoxy-N-(4,5-dimethoxy-2-nitrophenyl)-
	CAS Number	5739-55-9	Molecular Weight	362.37700
	Density	1.232g/cm3	Boiling Point	554.7ºC at 760 mmHg
	Molecular Formula	C₁₈H₂₂N₂O₆	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	N-[2-(3,4-dimethoxyphenyl)ethyl]-4,5-dimethoxy-2-nitroaniline

Density	1.232g/cm3
Boiling Point	554.7ºC at 760 mmHg
Molecular Formula	C₁₈H₂₂N₂O₆
Molecular Weight	362.37700
Exact Mass	362.14800
PSA	94.77000
LogP	3.88000
Index of Refraction	1.583
InChIKey	FTCJLGVRQQUJSE-UHFFFAOYSA-N
SMILES	COc1ccc(CCNc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1OC

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DA0184500

CHEMICAL NAME :: Benzeneethanamine, 3,4-dimethoxy-N-(4,5-dimethoxy-2-nitrophenyl)-

CAS REGISTRY NUMBER :: 5739-55-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H22-N2-O6

MOLECULAR WEIGHT :: 362.42

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 600 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: IJOCAP Indian Journal of Chemistry. (New Delhi, India) V.1-13, 1963-75. Divided into Indian Journal of Chemistry, Section A and Indian Journal of Chemistry, Section B. Volume(issue)/page/year: 12,124,1974

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