4-N,4-N-dimethyl-1-N-(2-nitro-1-benzothiophen-3-yl)benzene-1,4-diamine

Names

[ CAS No. ]:
128554-91-6

[ Name ]:
4-N,4-N-dimethyl-1-N-(2-nitro-1-benzothiophen-3-yl)benzene-1,4-diamine

Chemical & Physical Properties

[ Density]:
1.369g/cm3

[ Boiling Point ]:
499.2ºC at 760mmHg

[ Molecular Formula ]:
C16H15N3O2S

[ Molecular Weight ]:
313.37400

[ Flash Point ]:
255.7ºC

[ Exact Mass ]:
313.08800

[ PSA ]:
89.33000

[ LogP ]:
5.21530

[ Vapour Pressure ]:
4.23E-10mmHg at 25°C

[ Index of Refraction ]:
1.744

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CZ1587000
CHEMICAL NAME :
1,4-Benzenediamine, N,N-dimethyl-N'-(2-nitrobenzo(b)thien-3-yl)-
CAS REGISTRY NUMBER :
128554-91-6
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C16-H15-N3-O2-S
MOLECULAR WEIGHT :
313.40

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 :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 45,29,1990
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 45,29,1990

Precursor & DownStream

Precursor

  • 3-Bromo-2-nitrobenzo[b]thiophene
  • N,N-Dimethyl-1,4-benzenediamine

DownStream