200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 113443-97-3
113443-97-3 | Propanedioic acid, 2-(2,5-dioxocyclopentyl)-2-hydroxy-, 1,3-diethyl ester
CAS No: 113443-97-3 Catalog No: AG0008MD MDL No:
Product Description
Catalog Number:
AG0008MD
Chemical Name:
Propanedioic acid, 2-(2,5-dioxocyclopentyl)-2-hydroxy-, 1,3-diethyl ester
CAS Number:
113443-97-3
Molecular Formula:
C12H16O7
Molecular Weight:
272.2512
IUPAC Name:
diethyl 2-(2,5-dioxocyclopentyl)-2-hydroxypropanedioate
InChI:
InChI=1S/C12H16O7/c1-3-18-10(15)12(17,11(16)19-4-2)9-7(13)5-6-8(9)14/h9,17H,3-6H2,1-2H3
InChI Key:
KJRPNGKEEWTAID-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C1C(=O)CCC1=O)(C(=O)OCC)O
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.253g/mol
Monoisotopic Mass:
272.09g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.