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823188-92-7 | 2-Propynamide, N-[(3,5-dimethylphenyl)methyl]-N-methyl-3-phenyl-
CAS No: 823188-92-7 Catalog No: AG004ZJL MDL No:
Product Description
Catalog Number:
AG004ZJL
Chemical Name:
2-Propynamide, N-[(3,5-dimethylphenyl)methyl]-N-methyl-3-phenyl-
CAS Number:
823188-92-7
Molecular Formula:
C19H19NO
Molecular Weight:
277.3603
IUPAC Name:
N-[(3,5-dimethylphenyl)methyl]-N-methyl-3-phenylprop-2-ynamide
InChI:
InChI=1S/C19H19NO/c1-15-11-16(2)13-18(12-15)14-20(3)19(21)10-9-17-7-5-4-6-8-17/h4-8,11-13H,14H2,1-3H3
InChI Key:
GMPNOQXWOSPHCM-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(c1)C)CN(C(=O)C#Cc1ccccc1)C
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.147g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.367g/mol
Monoisotopic Mass:
277.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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