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78371-17-2 | Benzamide, N-(1,1-dimethyl-3-oxobutyl)-
CAS No: 78371-17-2 Catalog No: AG0053KK MDL No:
Product Description
Catalog Number:
AG0053KK
Chemical Name:
Benzamide, N-(1,1-dimethyl-3-oxobutyl)-
CAS Number:
78371-17-2
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
IUPAC Name:
N-(2-methyl-4-oxopentan-2-yl)benzamide
InChI:
InChI=1S/C13H17NO2/c1-10(15)9-13(2,3)14-12(16)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,14,16)
InChI Key:
VLTCYGUFKYJIOG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)NC(CC(=O)C)(C)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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