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132733-64-3 | 4-Nonyn-1-one, 1-cyclohexyl-
CAS No: 132733-64-3 Catalog No: AG001123 MDL No:
Product Description
Catalog Number:
AG001123
Chemical Name:
4-Nonyn-1-one, 1-cyclohexyl-
CAS Number:
132733-64-3
Molecular Formula:
C15H24O
Molecular Weight:
220.3505
IUPAC Name:
1-cyclohexylnon-4-yn-1-one
InChI:
InChI=1S/C15H24O/c1-2-3-4-5-6-10-13-15(16)14-11-8-7-9-12-14/h14H,2-4,7-13H2,1H3
InChI Key:
LOXWDRUXWGYMFU-UHFFFAOYSA-N
SMILES:
CCCCC#CCCC(=O)C1CCCCC1
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.183g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.356g/mol
Monoisotopic Mass:
220.183g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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