3-Buten-2-one, 4-(2,2,6-trimethylcyclohexenyl)-


Chemical Name: 3-Buten-2-one, 4-(2,2,6-trimethylcyclohexenyl)-
CAS Number: 14901-07-6
Product Number: AG00396F(AGN-PC-00S3G5)
Synonyms:
MDL No:
Molecular Formula: C13H20O
Molecular Weight: 192.2973

Identification/Properties


Computed Properties
Molecular Weight:
192.302g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
192.151g/mol
Monoisotopic Mass:
192.151g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
292
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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