200,000+ products from a single source!
sales@angenechem.com
17849-62-6 | Benzenepropanenitrile, α-chloro-
CAS No: 17849-62-6 Catalog No: AG00263E MDL No:MFCD00995426
Product Description
Catalog Number:
AG00263E
Chemical Name:
Benzenepropanenitrile, α-chloro-
CAS Number:
17849-62-6
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
MDL Number:
MFCD00995426
IUPAC Name:
2-chloro-3-phenylpropanenitrile
InChI:
InChI=1S/C9H8ClN/c10-9(7-11)6-8-4-2-1-3-5-8/h1-5,9H,6H2
InChI Key:
ZUPBNBYEVVGQKK-UHFFFAOYSA-N
SMILES:
ClC(Cc1ccccc1)C#N
NSC Number:
80631
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.035g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.62g/mol
Monoisotopic Mass:
165.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.