3,4-Dichlorophenylacetonitrile

Names

[ Name ]:
3,4-Dichlorophenylacetonitrile

[Synonym ]:
3,4-dichlorobenzeneacetonitrile
2-(3,4-dichlorophenyl)acetonitrile
m,p-dichlorophenylacetonitrile
Benzeneacetonitrile, 3,4-dichloro-
3,4-Dichlorobenzyl cyanide
EINECS 221-743-9
(3,4-Dichlorophenyl)acetonitrile
3,4-Dichlorophenylacetonitrile
MFCD00001909

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
308.6±0.0 °C at 760 mmHg

[ Melting Point ]:
39-42 °C(lit.)

[ Molecular Formula ]:
C₈H₅Cl₂N

[ Molecular Weight ]:
186.038

[ Flash Point ]:
125.9±17.4 °C

[ Exact Mass ]:
184.979904

[ PSA ]:
23.79000

[ LogP ]:
2.51

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

[ Index of Refraction ]:
1.566

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302 + H312 + H332-H315-H319-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

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

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R20/21/22;R36/37/38

[ Safety Phrases ]:
S26-S37/39-S36/37/39

[ RIDADR ]:
3276

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
29269095

Precursor & DownStream

Precursor

DownStream

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

Pharmacological profile and chemical synthesis of SR 48968, a non-peptide antagonist of the neurokinin A (NK₂) receptor. Emonds-Alt X, et al.

Bioorg. Med. Chem. Lett. 3(5) , 925-30, (1993)

A practical and scalable synthesis of SR 142801, a tachykinin NK3 antagonist. Chen HG, et al.

Bioorg. Med. Chem. Lett. 7(5) , 555-60, (1997)

Identification and chemical synthesis of MDL 105,212, a non-peptide tachykinin antagonist with high affinity for NK₁and NK₂ receptors. Burkholder TP, et al.

Bioorg. Med. Chem. Lett. 6(8) , 951-56, (1996)