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88382-30-3 | 2,2-Oxiranedicarboxylic acid, 3-(2,2-dichloroethenyl)-, diethyl ester
CAS No: 88382-30-3 Catalog No: AG004M26 MDL No:
Product Description
Catalog Number:
AG004M26
Chemical Name:
2,2-Oxiranedicarboxylic acid, 3-(2,2-dichloroethenyl)-, diethyl ester
CAS Number:
88382-30-3
Molecular Formula:
C10H12Cl2O5
Molecular Weight:
283.1053
IUPAC Name:
diethyl 3-(2,2-dichloroethenyl)oxirane-2,2-dicarboxylate
InChI:
InChI=1S/C10H12Cl2O5/c1-3-15-8(13)10(9(14)16-4-2)6(17-10)5-7(11)12/h5-6H,3-4H2,1-2H3
InChI Key:
MTIYBTYKNVINGR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(OC1C=C(Cl)Cl)C(=O)OCC
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.006g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.101g/mol
Monoisotopic Mass:
282.006g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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