200,000+ products from a single source!
sales@angenechem.com
137814-74-5 | Benzonitrile, 4-[2-(4-chlorophenyl)-2-oxiranyl]-
CAS No: 137814-74-5 Catalog No: AG0013W5 MDL No:
Product Description
Catalog Number:
AG0013W5
Chemical Name:
Benzonitrile, 4-[2-(4-chlorophenyl)-2-oxiranyl]-
CAS Number:
137814-74-5
Molecular Formula:
C15H10ClNO
Molecular Weight:
255.6990
IUPAC Name:
4-[2-(4-chlorophenyl)oxiran-2-yl]benzonitrile
InChI:
InChI=1S/C15H10ClNO/c16-14-7-5-13(6-8-14)15(10-18-15)12-3-1-11(9-17)2-4-12/h1-8H,10H2
InChI Key:
VCCWZWPHSBWWFP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C1(CO1)c1ccc(cc1)Cl
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.045g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.701g/mol
Monoisotopic Mass:
255.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.