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3,4-Dichlorophenylacetonitrile

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3,4-Dichlorophenylacetonitrile Basic information

Product Name:
3,4-Dichlorophenylacetonitrile
Synonyms:
  • Benzeneacetonitrile, 3,4-dichloro-
  • 3,4-Dichlorophenylacetonitrile,98%
  • 3,4-DICHLOROPHENYLACETONITRILE
  • 3,4-DICHLOROBENZYL CYANIDE
  • 3,4-DCCN
  • 2-(3,4-DICHLOROPHENYL)ACETONITRILE
  • 3,4-Dichlorobenzeneacetonitrile
  • 3,4-Dichlorophenylac
CAS:
3218-49-3
MF:
C8H5Cl2N
MW:
186.04
EINECS:
221-743-9
Product Categories:
  • Nitrogen Compounds
  • Organic Building Blocks
  • Building Blocks
  • C8 to C9
  • Chemical Synthesis
  • Cyanides/Nitriles
  • Chemical intermediate for Osanetant
  • Aromatic Phenylacetic Acids and Derivatives
Mol File:
3218-49-3.mol
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3,4-Dichlorophenylacetonitrile Chemical Properties

Melting point:
39-42 °C (lit.)
Boiling point:
170 °C/12 mmHg (lit.)
Density 
1.4274 (rough estimate)
refractive index 
1.5690 (estimate)
Flash point:
>230 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Crystalline Powder
color 
White
BRN 
638749
Exposure limits
NIOSH: IDLH 25 mg/m3
Stability:
Light Sensitive
CAS DataBase Reference
3218-49-3(CAS DataBase Reference)
NIST Chemistry Reference
3,4-Dichlorophenylacetonitrile(3218-49-3)
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Safety Information

Hazard Codes 
Xn,Xi
Risk Statements 
20/21/22-36/37/38
Safety Statements 
26-37/39-36/37/39
RIDADR 
3276
WGK Germany 
3
Hazard Note 
Irritant
HazardClass 
6.1
PackingGroup 
III
HS Code 
29269095

MSDS

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3,4-Dichlorophenylacetonitrile Usage And Synthesis

Chemical Properties

WHITE CRYSTALLINE POWDER

Uses

3,4-Dichlorophenylacetonitrile was used in the synthesis of:

  • SR 48968, a potent, competitive and selective non-peptide antagonist of the neurokinin A (NK2) receptor
  • tachykinin NK3 receptor antagonist SR 142801, (R)-N-[ 1-[3-[ 1-benzoyl-3-(3,4-dichlororphenyl)-3-piperidinyl]propyyl]-4-phenyl-4-piperidinyl-N-methyl acetamide
  • MDL 105,212, a non-peptide tachykinin receptor antagonist

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