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188761-06-0 | Propanedioic acid, 2-(1,3-dioxolan-2-yl)-, 1,3-diethyl ester
CAS No: 188761-06-0 Catalog No: AG002H9S MDL No:
Product Description
Catalog Number:
AG002H9S
Chemical Name:
Propanedioic acid, 2-(1,3-dioxolan-2-yl)-, 1,3-diethyl ester
CAS Number:
188761-06-0
Molecular Formula:
C10H16O6
Molecular Weight:
232.2304
IUPAC Name:
diethyl 2-(1,3-dioxolan-2-yl)propanedioate
InChI:
InChI=1S/C10H16O6/c1-3-13-8(11)7(9(12)14-4-2)10-15-5-6-16-10/h7,10H,3-6H2,1-2H3
InChI Key:
BUHOCZDNXQLTSJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C1OCCO1)C(=O)OCC
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.232g/mol
Monoisotopic Mass:
232.095g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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