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78371-20-7 | Benzamide, N-(1,1-dimethyl-2,3-dioxo-3-phenylpropyl)-
CAS No: 78371-20-7 Catalog No: AG005BEW MDL No:
Product Description
Catalog Number:
AG005BEW
Chemical Name:
Benzamide, N-(1,1-dimethyl-2,3-dioxo-3-phenylpropyl)-
CAS Number:
78371-20-7
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
IUPAC Name:
N-(2-methyl-3,4-dioxo-4-phenylbutan-2-yl)benzamide
InChI:
InChI=1S/C18H17NO3/c1-18(2,19-17(22)14-11-7-4-8-12-14)16(21)15(20)13-9-5-3-6-10-13/h3-12H,1-2H3,(H,19,22)
InChI Key:
HVJGYFHGPFVTNI-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)NC(C(=O)C(=O)c1ccccc1)(C)C
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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