Home Halogens 2-chloro-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)propanamide

2-chloro-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)propanamide

CAS No.:
1154151-27-5
Catalog Number:
AG019KRR
Molecular Formula:
C14H17ClN2O
Molecular Weight:
264.7506
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Product Description
Catalog Number:
AG019KRR
Chemical Name:
2-chloro-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)propanamide
CAS Number:
1154151-27-5
Molecular Formula:
C14H17ClN2O
Molecular Weight:
264.7506
MDL Number:
MFCD12469461
IUPAC Name:
2-chloro-N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)propanamide
InChI:
InChI=1S/C14H17ClN2O/c1-10-7-11(2)9-13(8-10)17(6-4-5-16)14(18)12(3)15/h7-9,12H,4,6H2,1-3H3
InChI Key:
ZXBLTWBHXLZJPA-UHFFFAOYSA-N
SMILES:
CC(C(=O)N(c1cc(C)cc(c1)C)CCC#N)Cl
Properties
Complexity:
326  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.103g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.753g/mol
Monoisotopic Mass:
264.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties