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89523-74-0 | 11-Dodecen-5-one, 10-hydroxy-
CAS No: 89523-74-0 Catalog No: AG00407P MDL No:
Product Description
Catalog Number:
AG00407P
Chemical Name:
11-Dodecen-5-one, 10-hydroxy-
CAS Number:
89523-74-0
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
IUPAC Name:
10-hydroxydodec-11-en-5-one
InChI:
InChI=1S/C12H22O2/c1-3-5-8-12(14)10-7-6-9-11(13)4-2/h4,11,13H,2-3,5-10H2,1H3
InChI Key:
SQAKTCZMHQKUCD-UHFFFAOYSA-N
SMILES:
CCCCC(=O)CCCCC(C=C)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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