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125889-22-7 | Propanamide, N-(4-methoxy-2-methylphenyl)-2,2-dimethyl-
CAS No: 125889-22-7 Catalog No: AG000OX7 MDL No:
Product Description
Catalog Number:
AG000OX7
Chemical Name:
Propanamide, N-(4-methoxy-2-methylphenyl)-2,2-dimethyl-
CAS Number:
125889-22-7
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
IUPAC Name:
N-(4-methoxy-2-methylphenyl)-2,2-dimethylpropanamide
InChI:
InChI=1S/C13H19NO2/c1-9-8-10(16-5)6-7-11(9)14-12(15)13(2,3)4/h6-8H,1-5H3,(H,14,15)
InChI Key:
KQJHHHFPSAKVML-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C)NC(=O)C(C)(C)C
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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