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149916-75-6 | 3-Octynamide, 2-hydroxy-2-methyl-N-phenyl-
CAS No: 149916-75-6 Catalog No: AG001M4J MDL No:
Product Description
Catalog Number:
AG001M4J
Chemical Name:
3-Octynamide, 2-hydroxy-2-methyl-N-phenyl-
CAS Number:
149916-75-6
Molecular Formula:
C15H19NO2
Molecular Weight:
245.3169
IUPAC Name:
3-hydroxy-N-phenylnon-4-ynamide
InChI:
InChI=1S/C15H19NO2/c1-2-3-4-8-11-14(17)12-15(18)16-13-9-6-5-7-10-13/h5-7,9-10,14,17H,2-4,12H2,1H3,(H,16,18)
InChI Key:
MFMAWLRUCPSWRF-UHFFFAOYSA-N
SMILES:
CCCCC#CC(C(=O)Nc1ccccc1)(O)C
Properties
Complexity:
307
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.322g/mol
Monoisotopic Mass:
245.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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