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873405-12-0 | 7-Octynamide
CAS No: 873405-12-0 Catalog No: AG004O30 MDL No:
Product Description
Catalog Number:
AG004O30
Chemical Name:
7-Octynamide
CAS Number:
873405-12-0
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
IUPAC Name:
oct-7-ynamide
InChI:
InChI=1S/C8H13NO/c1-2-3-4-5-6-7-8(9)10/h1H,3-7H2,(H2,9,10)
InChI Key:
NBWHAWTXMITPPG-UHFFFAOYSA-N
SMILES:
C#CCCCCCC(=O)N
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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