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100990-57-6 | Benzamide, N-[4-(1-methylethyl)phenyl]-
CAS No: 100990-57-6 Catalog No: AG0003E4 MDL No:
Product Description
Catalog Number:
AG0003E4
Chemical Name:
Benzamide, N-[4-(1-methylethyl)phenyl]-
CAS Number:
100990-57-6
Molecular Formula:
C16H17NO
Molecular Weight:
239.3123
IUPAC Name:
N-(4-propan-2-ylphenyl)benzamide
InChI:
InChI=1S/C16H17NO/c1-12(2)13-8-10-15(11-9-13)17-16(18)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,17,18)
InChI Key:
HWVROWYWWUNAGI-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)NC(=O)c1ccccc1)C
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.131g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.318g/mol
Monoisotopic Mass:
239.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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