37642-61-8

37642-61-8 structure

37642-61-8 structure

Name: 2-([(4-bromophenyl)sulfonyl]amino)-3-phenylpropanoic acid
Chemical Name: 2-([(4-bromophenyl)sulfonyl]amino)-3-phenylpropanoic acid
CAS Number: 37642-61-8
Molecular Formula: C₁₅H₁₄BrNO₄S
Molecular Weight: 384.24500
Create Date: 2018-12-29 09:38:53
Modify Date: 2024-04-02 20:06:47

Name	2-([(4-bromophenyl)sulfonyl]amino)-3-phenylpropanoic acid
Synonyms	N-p-Bromphenyl-2-azaspiro<4.5>decan-1,3-dion N-p-Bromphenyl-3-brompropionamid N-p-Bromphenylsulfonyl-D,L-phenylalanin N-p-Brombenzolsulfonyl-DL-phenylalanin

Density	1.568g/cm3
Boiling Point	544.7ºC at 760 mmHg
Melting Point	165-167ºC
Molecular Formula	C₁₅H₁₄BrNO₄S
Molecular Weight	384.24500
Flash Point	283.2ºC
Exact Mass	382.98300
PSA	91.85000
LogP	3.89500
Index of Refraction	1.63

CHEMICAL IDENTIFICATION

RTECS NUMBER :: AY4251000

CHEMICAL NAME :: Alanine, N-(p-bromobenzenesulfonyl)-3-phenyl-, DL-

CAS REGISTRY NUMBER :: 37642-61-8

LAST UPDATED :: 199012

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C15-H14-Br-N-O4-S

MOLECULAR WEIGHT :: 384.27

WISWESSER LINE NOTATION :: QVY1R&MSWR DE -DL

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 385 mg/kg

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

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 15,1325,1972

Hazard Codes	Xi
HS Code	2935009090

HS Code	2935009090
Summary	2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%