200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88339-58-6
88339-58-6 | 2-Cyclohexen-1-one, 5-(3-acetyl-2,4,6-trimethylphenyl)-3-hydroxy-
CAS No: 88339-58-6 Catalog No: AG0047WU MDL No:
Product Description
Catalog Number:
AG0047WU
Chemical Name:
2-Cyclohexen-1-one, 5-(3-acetyl-2,4,6-trimethylphenyl)-3-hydroxy-
CAS Number:
88339-58-6
Molecular Formula:
C17H20O3
Molecular Weight:
272.3389
IUPAC Name:
5-(3-acetyl-2,4,6-trimethylphenyl)-3-hydroxycyclohex-2-en-1-one
InChI:
InChI=1S/C17H20O3/c1-9-5-10(2)17(11(3)16(9)12(4)18)13-6-14(19)8-15(20)7-13/h5,8,13,19H,6-7H2,1-4H3
InChI Key:
OKQHLYODFYTQHW-UHFFFAOYSA-N
SMILES:
OC1=CC(=O)CC(C1)c1c(C)cc(c(c1C)C(=O)C)C
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.141g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.344g/mol
Monoisotopic Mass:
272.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.