200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 83467-87-2
83467-87-2 | 2-Butanone, 1-bicyclo[4.1.0]hept-2-ylidene-3,3-dimethyl-
CAS No: 83467-87-2 Catalog No: AG0053ZE MDL No:
Product Description
Catalog Number:
AG0053ZE
Chemical Name:
2-Butanone, 1-bicyclo[4.1.0]hept-2-ylidene-3,3-dimethyl-
CAS Number:
83467-87-2
Molecular Formula:
C13H20O
Molecular Weight:
192.2973
IUPAC Name:
1-(2-bicyclo[4.1.0]heptanylidene)-3,3-dimethylbutan-2-one
InChI:
InChI=1S/C13H20O/c1-13(2,3)12(14)8-10-6-4-5-9-7-11(9)10/h8-9,11H,4-7H2,1-3H3
InChI Key:
URROMGONCQNNMD-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)C=C1CCCC2C1C2
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.151g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.302g/mol
Monoisotopic Mass:
192.151g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.