200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88958-85-4
88958-85-4 | 3-Penten-2-one, 1-(4-methoxyphenyl)-4-methyl-1-(phenylsulfonyl)-
CAS No: 88958-85-4 Catalog No: AG0046JO MDL No:
Product Description
Catalog Number:
AG0046JO
Chemical Name:
3-Penten-2-one, 1-(4-methoxyphenyl)-4-methyl-1-(phenylsulfonyl)-
CAS Number:
88958-85-4
Molecular Formula:
C19H20O4S
Molecular Weight:
344.4247
IUPAC Name:
1-(benzenesulfonyl)-1-(4-methoxyphenyl)-4-methylpent-3-en-2-one
InChI:
InChI=1S/C19H20O4S/c1-14(2)13-18(20)19(15-9-11-16(23-3)12-10-15)24(21,22)17-7-5-4-6-8-17/h4-13,19H,1-3H3
InChI Key:
FDAFZWVFMZFHQO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C(S(=O)(=O)c1ccccc1)C(=O)C=C(C)C
Properties
Complexity:
540
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.108g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.425g/mol
Monoisotopic Mass:
344.108g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
68.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.