200,000+ products from a single source!
sales@angenechem.com
113859-85-1 | 2-Cyclohexen-1-one, 5,5-dimethyl-3-[(2-oxo-1,2-diphenylethyl)amino]-
CAS No: 113859-85-1 Catalog No: AG0009YG MDL No:
Product Description
Catalog Number:
AG0009YG
Chemical Name:
2-Cyclohexen-1-one, 5,5-dimethyl-3-[(2-oxo-1,2-diphenylethyl)amino]-
CAS Number:
113859-85-1
Molecular Formula:
C22H23NO2
Molecular Weight:
333.4235
IUPAC Name:
5,5-dimethyl-3-[(2-oxo-1,2-diphenylethyl)amino]cyclohex-2-en-1-one
InChI:
InChI=1S/C22H23NO2/c1-22(2)14-18(13-19(24)15-22)23-20(16-9-5-3-6-10-16)21(25)17-11-7-4-8-12-17/h3-13,20,23H,14-15H2,1-2H3
InChI Key:
MJUXSIRZLNLTDV-UHFFFAOYSA-N
SMILES:
O=C1C=C(NC(C(=O)c2ccccc2)c2ccccc2)CC(C1)(C)C
Properties
Complexity:
522
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.173g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.431g/mol
Monoisotopic Mass:
333.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.