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74810-53-0 | 6-Octen-2-one, (6Z)-
CAS No: 74810-53-0 Catalog No: AG005GWL MDL No:
Product Description
Catalog Number:
AG005GWL
Chemical Name:
6-Octen-2-one, (6Z)-
CAS Number:
74810-53-0
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
IUPAC Name:
(Z)-oct-6-en-2-one
InChI:
InChI=1S/C8H14O/c1-3-4-5-6-7-8(2)9/h3-4H,5-7H2,1-2H3/b4-3-
InChI Key:
FPXPWFLCGOFSTQ-ARJAWSKDSA-N
SMILES:
C/C=C\CCCC(=O)C
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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