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198404-44-3 | Benzamide, N-[2-(4-methoxyphenyl)ethyl]-4-methyl-
CAS No: 198404-44-3 Catalog No: AG002BHK MDL No:
Product Description
Catalog Number:
AG002BHK
Chemical Name:
Benzamide, N-[2-(4-methoxyphenyl)ethyl]-4-methyl-
CAS Number:
198404-44-3
Molecular Formula:
C17H19NO2
Molecular Weight:
269.3383
IUPAC Name:
N-[2-(4-methoxyphenyl)ethyl]-4-methylbenzamide
InChI:
InChI=1S/C17H19NO2/c1-13-3-7-15(8-4-13)17(19)18-12-11-14-5-9-16(20-2)10-6-14/h3-10H,11-12H2,1-2H3,(H,18,19)
InChI Key:
STEXFMXXNJKSDD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CCNC(=O)c1ccc(cc1)C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.142g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.344g/mol
Monoisotopic Mass:
269.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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