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7354-44-1 | Acetamide, N-[2-(3-methylphenyl)ethyl]-
CAS No: 7354-44-1 Catalog No: AG005D3K MDL No:
Product Description
Catalog Number:
AG005D3K
Chemical Name:
Acetamide, N-[2-(3-methylphenyl)ethyl]-
CAS Number:
7354-44-1
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
N-[2-(3-methylphenyl)ethyl]acetamide
InChI:
InChI=1S/C11H15NO/c1-9-4-3-5-11(8-9)6-7-12-10(2)13/h3-5,8H,6-7H2,1-2H3,(H,12,13)
InChI Key:
BQMFPUHBOKWLOJ-UHFFFAOYSA-N
SMILES:
CC(=O)NCCc1cccc(c1)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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