Cycloheptenone


Chemical Name: Cycloheptenone
CAS Number: 1121-66-0
Product Number: AG008RAS(AGN-PC-0JL9VW)
Synonyms:
MDL No:
Molecular Formula: C7H10O
Molecular Weight: 110.1537

Identification/Properties


Properties
BP:
189.1 °C at 760 mmHg
Storage:
-10 ℃;
Form:
Liquid
Refractive Index:
n20/D 1.494(lit.)
Computed Properties
Molecular Weight:
110.156g/mol
XLogP3:
1.4
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:
114
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


NMR Spectrum


Other Analytical Data


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