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Home > Other Building Blocks > 82456-34-6
82456-34-6 | 3-Nonen-5-one
CAS No: 82456-34-6 Catalog No: AG0059K8 MDL No:
Product Description
Catalog Number:
AG0059K8
Chemical Name:
3-Nonen-5-one
CAS Number:
82456-34-6
Molecular Formula:
C9H16O
Molecular Weight:
140.2227
IUPAC Name:
non-3-en-5-one
InChI:
InChI=1S/C9H16O/c1-3-5-7-9(10)8-6-4-2/h5,7H,3-4,6,8H2,1-2H3
InChI Key:
FRMKAKWKXLDSSR-UHFFFAOYSA-N
SMILES:
CCCCC(=O)C=CCC
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.12g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.226g/mol
Monoisotopic Mass:
140.12g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.6
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