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1901-45-7 | 4-Dodecanone, 1-hydroxy-
CAS No: 1901-45-7 Catalog No: AG002ECB MDL No:
Product Description
Catalog Number:
AG002ECB
Chemical Name:
4-Dodecanone, 1-hydroxy-
CAS Number:
1901-45-7
Molecular Formula:
C12H24O2
Molecular Weight:
200.3178
IUPAC Name:
1-hydroxydodecan-4-one
InChI:
InChI=1S/C12H24O2/c1-2-3-4-5-6-7-9-12(14)10-8-11-13/h13H,2-11H2,1H3
InChI Key:
ZWRNUBJKJQOMRO-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)CCCO
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.178g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.322g/mol
Monoisotopic Mass:
200.178g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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