200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 20474-50-4
20474-50-4 | 3-Pentanone, 2,2-dimethyl-4-phenyl-
CAS No: 20474-50-4 Catalog No: AG0029P5 MDL No:
Product Description
Catalog Number:
AG0029P5
Chemical Name:
3-Pentanone, 2,2-dimethyl-4-phenyl-
CAS Number:
20474-50-4
Molecular Formula:
C13H18O
Molecular Weight:
190.2814
IUPAC Name:
2,2-dimethyl-4-phenylpentan-3-one
InChI:
InChI=1S/C13H18O/c1-10(12(14)13(2,3)4)11-8-6-5-7-9-11/h5-10H,1-4H3
InChI Key:
QZJXYOGAZYAYDK-UHFFFAOYSA-N
SMILES:
CC(C(=O)C(C)(C)C)c1ccccc1
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.286g/mol
Monoisotopic Mass:
190.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.