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13156-97-3 | Propanamide, 2-chloro-N-(2-phenylethyl)-
CAS No: 13156-97-3 Catalog No: AG000ZFC MDL No:MFCD01696002
Product Description
Catalog Number:
AG000ZFC
Chemical Name:
Propanamide, 2-chloro-N-(2-phenylethyl)-
CAS Number:
13156-97-3
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
MDL Number:
MFCD01696002
IUPAC Name:
2-chloro-N-(2-phenylethyl)propanamide
InChI:
InChI=1S/C11H14ClNO/c1-9(12)11(14)13-8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,13,14)
InChI Key:
YMKVLIVAWASLAU-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)C)NCCc1ccccc1
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.076g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.689g/mol
Monoisotopic Mass:
211.076g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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