200,000+ products from a single source!
sales@angenechem.com
114291-42-8 | 2H-Pyran-2,4(3H)-dione, 3-(2,4-dichlorobenzoyl)-6-methyl-
CAS No: 114291-42-8 Catalog No: AG000AZ6 MDL No:
Product Description
Catalog Number:
AG000AZ6
Chemical Name:
2H-Pyran-2,4(3H)-dione, 3-(2,4-dichlorobenzoyl)-6-methyl-
CAS Number:
114291-42-8
Molecular Formula:
C13H8Cl2O4
Molecular Weight:
299.1062
IUPAC Name:
3-(2,4-dichlorobenzoyl)-6-methylpyran-2,4-dione
InChI:
InChI=1S/C13H8Cl2O4/c1-6-4-10(16)11(13(18)19-6)12(17)8-3-2-7(14)5-9(8)15/h2-5,11H,1H3
InChI Key:
XRRNKMMTGXALHW-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)C(C(=O)O1)C(=O)c1ccc(cc1Cl)Cl
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.98g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.103g/mol
Monoisotopic Mass:
297.98g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.