2-(4-[(4-Chlorobenzyl)Oxy]Phenyl)Acetonitrile

Base Information

• Chemical Name: 2-(4-[(4-Chlorobenzyl)Oxy]Phenyl)Acetonitrile
• CAS No.: 175135-36-1
• Molecular Formula: C15H12 Cl N O
• Molecular Weight: 257.71500
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID20379149
• Wikidata: Q82168826
• Mol file: 175135-36-1.mol

Synonyms:175135-36-1;2-(4-[(4-Chlorobenzyl)Oxy]Phenyl)Acetonitrile;2-{4-[(4-chlorobenzyl)oxy]phenyl}acetonitrile;2-[4-[(4-chlorophenyl)methoxy]phenyl]acetonitrile;Benzeneacetonitrile, 4-[(4-chlorophenyl)methoxy]-;2-{4-[(4-chlorophenyl)methoxy]phenyl}acetonitrile;2-(4-((4-Chlorobenzyl)oxy)phenyl)acetonitrile;Maybridge1_001897;Oprea1_088272;HMS546O05;DTXSID20379149;MFCD00067743;{4-[(4-Chlorophenyl)methoxy]phenyl};AKOS000198695;2-(4-(4-chlorobenzyloxy)phenyl)acetonitrile;FT-0610903;{4-[(4-Chlorophenyl)methoxy]phenyl}acetonitrile

Chemical Property of 2-(4-[(4-Chlorobenzyl)Oxy]Phenyl)Acetonitrile

Chemical Property:

• Vapor Pressure: 4.43E-07mmHg at 25°C
• Melting Point: 113oC
• Boiling Point: 414.5oC at 760 mmHg
• Flash Point: 204.5oC
• PSA: 33.02000
• Density: 1.213g/cm3
• LogP: 3.98508
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 257.0607417
• Heavy Atom Count: 18
• Complexity: 282

Purity/Quality:

98.5% ^*data from raw suppliers

2-(4-[(4-CHLOROBENZYL)OXY]PHENYL)ACETONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn:Harmful
• Statements: R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
• Safety Statements: S36/37:Wear suitable protective clothing and gloves.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CC#N)OCC2=CC=C(C=C2)Cl