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Home > Other Building Blocks > 89319-67-5
89319-67-5 | 6-Pentadecyn-8-one
CAS No: 89319-67-5 Catalog No: AG003ZKZ MDL No:
Product Description
Catalog Number:
AG003ZKZ
Chemical Name:
6-Pentadecyn-8-one
CAS Number:
89319-67-5
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
IUPAC Name:
pentadec-6-yn-8-one
InChI:
InChI=1S/C15H26O/c1-3-5-7-9-11-13-15(16)14-12-10-8-6-4-2/h3-11,13H2,1-2H3
InChI Key:
DKBPWXLDBXOSRV-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)C#CCCCCC
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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