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16707-61-2 | Acetamide, N-(1-methyl-1-phenylpropyl)-
CAS No: 16707-61-2 Catalog No: AG001X39 MDL No:
Product Description
Catalog Number:
AG001X39
Chemical Name:
Acetamide, N-(1-methyl-1-phenylpropyl)-
CAS Number:
16707-61-2
Molecular Formula:
C12H17NO
Molecular Weight:
191.2695
IUPAC Name:
N-(2-phenylbutan-2-yl)acetamide
InChI:
InChI=1S/C12H17NO/c1-4-12(3,13-10(2)14)11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H,13,14)
InChI Key:
FTLKXBZFHBBWRN-UHFFFAOYSA-N
SMILES:
CCC(c1ccccc1)(NC(=O)C)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.274g/mol
Monoisotopic Mass:
191.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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