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88642-01-7 | Cyclooctadecenone
CAS No: 88642-01-7 Catalog No: AG004929 MDL No:
Product Description
Catalog Number:
AG004929
Chemical Name:
Cyclooctadecenone
CAS Number:
88642-01-7
Molecular Formula:
C18H32O
Molecular Weight:
264.4461
IUPAC Name:
cyclooctadec-2-en-1-one
InChI:
InChI=1S/C18H32O/c19-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-18/h14,16H,1-13,15,17H2
InChI Key:
UEPVXMRVHGAQAD-UHFFFAOYSA-N
SMILES:
O=C1CCCCCCCCCCCCCCCC=C1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.245g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.453g/mol
Monoisotopic Mass:
264.245g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.4
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