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90292-78-7

90292-78-7 | Benzonitrile, 2-(chlorophenylmethyl)-

CAS No: 90292-78-7 Catalog No: AG006GM0 MDL No:

Product Description

Catalog Number:
AG006GM0
Chemical Name:
Benzonitrile, 2-(chlorophenylmethyl)-
CAS Number:
90292-78-7
Molecular Formula:
C14H10ClN
Molecular Weight:
227.6889
IUPAC Name:
2-[chloro(phenyl)methyl]benzonitrile
InChI:
InChI=1S/C14H10ClN/c15-14(11-6-2-1-3-7-11)13-9-5-4-8-12(13)10-16/h1-9,14H
InChI Key:
NJZFPTZWAOHBTK-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1C(c1ccccc1)Cl

Properties

Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.05g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.691g/mol
Monoisotopic Mass:
227.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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