3,4-Dichlorophenylacetonitrile

3,4-Dichlorophenylacetonitrile Basic information
Product Name:3,4-Dichlorophenylacetonitrile
Synonyms:Benzeneacetonitrile, 3,4-dichloro-;3,4-Dichlorophenylacetonitrile,98%;3,4-DICHLOROPHENYLACETONITRILE;3,4-DCCN;3,4-Dichlorobenzeneacetonitrile;3,4-Dichlorophenylac;3,4-Dichlorophenylacetonitrile, 98% 25GR;3,4-DICHLOROPHENYLCYANIDE
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;Aromatic Phenylacetic Acids and Derivatives;Chemical intermediate for Osanetant
Mol File:3218-49-3.mol
3,4-Dichlorophenylacetonitrile Structure
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)
Fp >230 °F
storage temp. Sealed in dry,Room Temperature
solubility Chloroform (Slightly), Methanol (Slightly)
form Crystalline Powder
color White
BRN 638749
Exposure limitsNIOSH: IDLH 25 mg/m3
Stability:Light Sensitive
CAS DataBase Reference3218-49-3(CAS DataBase Reference)
NIST Chemistry Reference3,4-Dichlorophenylacetonitrile(3218-49-3)
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 Information
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3,4-Dichlorophenylacetonitrile Usage And Synthesis
Chemical PropertiesWHITE CRYSTALLINE POWDER
Uses3,4-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
2-(2,4,5-trichlorophenyl)acetonitrile amino(3,4-dichlorophenyl)acetonitrile 1-(3,4-DICHLOROPHENYL)CYCLOPROPANECARBONITRILE 1-(3,4-DICHLOROPHENYL)CYCLOPENTANECARBONITRILE (Z)-2-(3,4-DICHLOROPHENYL)-3-[2-(METHYLSULFANYL)-3-QUINOLINYL]-2-PROPENENITRILE RARECHEM AK ML 0163 2-(3,4-DICHLOROPHENYL)-3-[2-(ETHYLSULFANYL)-1-METHYL-1H-IMIDAZOL-5-YL]ACRYLONITRILE (Z)-3-[5-CHLORO-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-4-YL]-2-(3,4-DICHLOROPHENYL)-2-PROPENENITRILE SALOR-INT L156051-1EA SALOR-INT L155055-1EA 2-(3,4-dichlorophenyl)-2-(piperazin-1-yl)acetonitrile 4-CYANO-4-(3,4-DICHLOROPHENYL)CYCLOHEXANONE Benzeneacetic acid, 3,4-dichloro-a-cyano- SALOR-INT L153265-1EA (Z)-3-[2-(4-CHLOROPHENYL)-5,6,7,8-TETRAHYDROIMIDAZO[2,1-B][1,3]BENZOTHIAZOL-3-YL]-2-(3,4-DICHLOROPHENYL)-2-PROPENENITRILE (Z)-3-[2-(4-CHLOROPHENYL)-8-METHYLIMIDAZO[1,2-A]PYRIDIN-3-YL]-2-(3,4-DICHLOROPHENYL)-2-PROPENENITRILE (6-Chloro-pyridazin-3-yl)-(3,4-dichloro-phenyl)-acetonitrile (Z)-3-(2-[(4-CHLOROBENZYL)SULFANYL]-3-QUINOLINYL)-2-(3,4-DICHLOROPHENYL)-2-PROPENENITRILE

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