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1181673-86-8 | 2-Chloro-N-cyclopropyl-N-(2-methyl-benzyl)-acetamide
CAS No: 1181673-86-8 Catalog No: AG01F8ER MDL No:
Product Description
Catalog Number:
AG01F8ER
Chemical Name:
2-Chloro-N-cyclopropyl-N-(2-methyl-benzyl)-acetamide
CAS Number:
1181673-86-8
Molecular Formula:
C13H16ClNO
Molecular Weight:
237.7252
IUPAC Name:
2-chloro-N-cyclopropyl-N-[(2-methylphenyl)methyl]acetamide
InChI:
InChI=1S/C13H16ClNO/c1-10-4-2-3-5-11(10)9-15(12-6-7-12)13(16)8-14/h2-5,12H,6-9H2,1H3
InChI Key:
HHXDUSNEXQTLJF-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C1CC1)Cc1ccccc1C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.092g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.727g/mol
Monoisotopic Mass:
237.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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