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89393-09-9 | 5-Nonanone, 4-hydroxy-
CAS No: 89393-09-9 Catalog No: AG003WK0 MDL No:
Product Description
Catalog Number:
AG003WK0
Chemical Name:
5-Nonanone, 4-hydroxy-
CAS Number:
89393-09-9
Molecular Formula:
C9H18O2
Molecular Weight:
158.2380
IUPAC Name:
4-hydroxynonan-5-one
InChI:
InChI=1S/C9H18O2/c1-3-5-7-9(11)8(10)6-4-2/h8,10H,3-7H2,1-2H3
InChI Key:
IABSAARXCAQGFZ-UHFFFAOYSA-N
SMILES:
CCCCC(=O)C(CCC)O
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.241g/mol
Monoisotopic Mass:
158.131g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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