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123772-66-7 | Acetamide, N-(1-phenyl-2-propyn-1-yl)-
CAS No: 123772-66-7 Catalog No: AG000L2E MDL No:
Product Description
Catalog Number:
AG000L2E
Chemical Name:
Acetamide, N-(1-phenyl-2-propyn-1-yl)-
CAS Number:
123772-66-7
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
IUPAC Name:
N-(1-phenylprop-2-ynyl)acetamide
InChI:
InChI=1S/C11H11NO/c1-3-11(12-9(2)13)10-7-5-4-6-8-10/h1,4-8,11H,2H3,(H,12,13)
InChI Key:
MDKARKRQSRKNGU-UHFFFAOYSA-N
SMILES:
C#CC(c1ccccc1)NC(=O)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.215g/mol
Monoisotopic Mass:
173.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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