4-Chloro-β-nitrostyrene

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Names

[ CAS No. ]:
706-07-0

[ Name ]:
4-Chloro-β-nitrostyrene

[Synonym ]:
p-Chloro-β-nitrostyrene
Styrene, p-chloro-β-nitro-
MFCD00024825
1-Chloro-4-[(E)-2-nitrovinyl]benzene
1-nitro-2-(4-chlorophenyl)ethene
4-Chloro-β-nitrostyrene
1-(p-chlorophenyl)-2-nitroethene
Benzene, 1-chloro-4-[(E)-2-nitroethenyl]-
1-chloro-4-(2-nitrovinyl)benzene
1-chloro-4-[(E)-2-nitroethenyl]benzene
Benzene, 1-chloro-4- (2-nitroethenyl)-

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
299.0±15.0 °C at 760 mmHg

[ Melting Point ]:
112-116 °C(lit.)

[ Molecular Formula ]:
C8H6ClNO2

[ Molecular Weight ]:
183.592

[ Flash Point ]:
134.6±20.4 °C

[ Exact Mass ]:
183.008713

[ PSA ]:
45.82000

[ LogP ]:
2.67

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.616

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
WL4200500
CHEMICAL NAME :
Styrene, p-chloro-beta-nitro-
CAS REGISTRY NUMBER :
706-07-0
BEILSTEIN REFERENCE NO. :
2208373
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C8-H6-Cl-N-O2
MOLECULAR WEIGHT :
183.60
WISWESSER LINE NOTATION :
WN1U1R DG

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 :
387 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AECTCV Archives of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 070944) V.1- 1973- Volume(issue)/page/year: 14,111,1985
TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
15 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 100,93,1961

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H302-H334

[ Precautionary Statements ]:
P261-P342 + P311

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R22;R43

[ Safety Phrases ]:
S36/37

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
WL4200500

[ HS Code ]:
2904909090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • nitromethane
  • 4-Chlorobenzaldehyde
  • 3-(4-Chlorophenyl)acrylic acid
  • 4-Chlorostyrene
  • 1-(4-chlorophenyl)-N-(4-methoxyphenyl)methanimine
  • 4-Chlorobenzaldehyde dimethyl acetal

DownStream

  • 7-Chloro-3,4-dihydro-1(2H)-isoquinolinone
  • diethyl 2-[1-(4-chlorophenyl)-2-nitro-ethyl]propanedioate
  • 2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
  • (R)-Baclofen
  • 1-chloro-4-(2-nitro-1-prop-2-enylsulfanylethyl)benzene
  • METHYL 3-(4-CHLOROPHENYL)-2-METHOXYCARBONYL-4-NITROBUTANOATE
  • 2-(4-CHLOROPHENYL)BENZIMIDAZOLE
  • 4-Chlorobenzyl cyanide
  • 4-chlorobenzeneethanamine
  • PHACLOFEN

Customs

[ HS Code ]: 2904909090

[ Summary ]:
HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Related Compounds

  • 4-chloro-β-nitrostyrene
  • 4-Chloro-β,β-dimethyl-L-phenylalanine
  • 4-chloro-β-(2-chlorophenyl)benzenepropanol
  • 4-chloro-β-(2,6-dichlorophenyl)benzenepropanol methanesulfonate
  • 4-Chloro-β-(1-methylpropyl)-N,N-dimethylbenzeneethanamine
  • sodium 4-chloro-β-phenethylsulfonate
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-(3,4-difluorophenyl)-1H-pyrazole hydrochloride
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide