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102156-83-2 | Hexanoic acid, 6-(benzoylamino)-, phenylmethyl ester
CAS No: 102156-83-2 Catalog No: AG0006RP MDL No:
Product Description
Catalog Number:
AG0006RP
Chemical Name:
Hexanoic acid, 6-(benzoylamino)-, phenylmethyl ester
CAS Number:
102156-83-2
Molecular Formula:
C20H23NO3
Molecular Weight:
325.4015
IUPAC Name:
benzyl 6-benzamidohexanoate
InChI:
InChI=1S/C20H23NO3/c22-19(24-16-17-10-4-1-5-11-17)14-8-3-9-15-21-20(23)18-12-6-2-7-13-18/h1-2,4-7,10-13H,3,8-9,14-16H2,(H,21,23)
InChI Key:
JIPYRMGBAMLVHN-UHFFFAOYSA-N
SMILES:
O=C(OCc1ccccc1)CCCCCNC(=O)c1ccccc1
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
325.408g/mol
Monoisotopic Mass:
325.168g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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