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823785-56-4 | 2-Cyclohexen-1-one, 2-undecyl-
CAS No: 823785-56-4 Catalog No: AG004YLZ MDL No:
Product Description
Catalog Number:
AG004YLZ
Chemical Name:
2-Cyclohexen-1-one, 2-undecyl-
CAS Number:
823785-56-4
Molecular Formula:
C17H30O
Molecular Weight:
250.4195
IUPAC Name:
2-undecylcyclohex-2-en-1-one
InChI:
InChI=1S/C17H30O/c1-2-3-4-5-6-7-8-9-10-13-16-14-11-12-15-17(16)18/h14H,2-13,15H2,1H3
InChI Key:
LGTSYTJOWIWQKX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC1=CCCCC1=O
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.23g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.426g/mol
Monoisotopic Mass:
250.23g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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