200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1353956-02-1
1353956-02-1 | 2-Chloro-N-(3-cyano-benzyl)-N-cyclopropyl-acetamide
CAS No: 1353956-02-1 Catalog No: AG01F8RF MDL No:
Product Description
Catalog Number:
AG01F8RF
Chemical Name:
2-Chloro-N-(3-cyano-benzyl)-N-cyclopropyl-acetamide
CAS Number:
1353956-02-1
Molecular Formula:
C13H13ClN2O
Molecular Weight:
248.7081
IUPAC Name:
2-chloro-N-[(3-cyanophenyl)methyl]-N-cyclopropylacetamide
InChI:
InChI=1S/C13H13ClN2O/c14-7-13(17)16(12-4-5-12)9-11-3-1-2-10(6-11)8-15/h1-3,6,12H,4-5,7,9H2
InChI Key:
ITIQRNBWZXSNKH-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C1CC1)Cc1cccc(c1)C#N
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.71g/mol
Monoisotopic Mass:
248.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
© 2019 Angene International Limited. All rights Reserved.