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1177232-83-5 | 2-Chloro-N-cyclopropyl-N-(3-methoxy-benzyl)-acetamide
CAS No: 1177232-83-5 Catalog No: AG01F860 MDL No:
Product Description
Catalog Number:
AG01F860
Chemical Name:
2-Chloro-N-cyclopropyl-N-(3-methoxy-benzyl)-acetamide
CAS Number:
1177232-83-5
Molecular Formula:
C13H16ClNO2
Molecular Weight:
253.7246
IUPAC Name:
2-chloro-N-cyclopropyl-N-[(3-methoxyphenyl)methyl]acetamide
InChI:
InChI=1S/C13H16ClNO2/c1-17-12-4-2-3-10(7-12)9-15(11-5-6-11)13(16)8-14/h2-4,7,11H,5-6,8-9H2,1H3
InChI Key:
VSIFZDNGCJZXTA-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(C1CC1)Cc1cccc(c1)OC
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.087g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.726g/mol
Monoisotopic Mass:
253.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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