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71231-25-9 | Benzenepropanamide, N-(4-methylphenyl)-
CAS No: 71231-25-9 Catalog No: AG005K1S MDL No:MFCD00442689
Product Description
Catalog Number:
AG005K1S
Chemical Name:
Benzenepropanamide, N-(4-methylphenyl)-
CAS Number:
71231-25-9
Molecular Formula:
C16H17NO
Molecular Weight:
239.3123
MDL Number:
MFCD00442689
IUPAC Name:
N-(4-methylphenyl)-3-phenylpropanamide
InChI:
InChI=1S/C16H17NO/c1-13-7-10-15(11-8-13)17-16(18)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H,17,18)
InChI Key:
ZEPROHGLZFUZOM-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)C)CCc1ccccc1
Properties
Complexity:
250
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:
4
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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