2-Cyclohexen-1-one, 3-methyl-


Chemical Name: 2-Cyclohexen-1-one, 3-methyl-
CAS Number: 1193-18-6
Product Number: AG000IJD(AGN-PC-0JKBS3)
Synonyms:
MDL No:
Molecular Formula: C7H10O
Molecular Weight: 110.1537

Identification/Properties


Computed Properties
Molecular Weight:
110.156g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
110.073g/mol
Monoisotopic Mass:
110.073g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
133
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H227-H302
Precautionary Statements:
P210-P264-P270-P280-P301+P312+P330-P370+P378-P403+P235-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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