Home Other Building Blocks Cyclohexanone, 4-heptyl-

Cyclohexanone, 4-heptyl-

CAS No.:
16618-75-0
Catalog Number:
AG001WJL
Molecular Formula:
C13H24O
Molecular Weight:
196.3291
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Product Description
Catalog Number:
AG001WJL
Chemical Name:
Cyclohexanone, 4-heptyl-
CAS Number:
16618-75-0
Molecular Formula:
C13H24O
Molecular Weight:
196.3291
MDL Number:
MFCD25978211
IUPAC Name:
4-heptylcyclohexan-1-one
InChI:
InChI=1S/C13H24O/c1-2-3-4-5-6-7-12-8-10-13(14)11-9-12/h12H,2-11H2,1H3
InChI Key:
QWHCPRHASHNSDA-UHFFFAOYSA-N
SMILES:
CCCCCCCC1CCC(=O)CC1
Properties
Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.183g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.334g/mol
Monoisotopic Mass:
196.183g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  
Properties