200,000+ products from a single source!
sales@angenechem.com
131425-77-9 | 2H-1-Benzopyran-2-one, 8-(3-chlorobenzoyl)-7-hydroxy-4-methyl-
CAS No: 131425-77-9 Catalog No: AG000W5X MDL No:
Product Description
Catalog Number:
AG000W5X
Chemical Name:
2H-1-Benzopyran-2-one, 8-(3-chlorobenzoyl)-7-hydroxy-4-methyl-
CAS Number:
131425-77-9
Molecular Formula:
C17H11ClO4
Molecular Weight:
314.7198
IUPAC Name:
8-(3-chlorobenzoyl)-7-hydroxy-4-methylchromen-2-one
InChI:
InChI=1S/C17H11ClO4/c1-9-7-14(20)22-17-12(9)5-6-13(19)15(17)16(21)10-3-2-4-11(18)8-10/h2-8,19H,1H3
InChI Key:
FRPHFIQYWOHTED-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)C(=O)c1c(O)ccc2c1oc(=O)cc2C
Properties
Complexity:
501
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.035g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.721g/mol
Monoisotopic Mass:
314.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.