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89215-44-1 | Butanedioic acid, 2-chloro-2-(2-chloroethyl)-, diethyl ester
CAS No: 89215-44-1 Catalog No: AG0043QN MDL No:
Product Description
Catalog Number:
AG0043QN
Chemical Name:
Butanedioic acid, 2-chloro-2-(2-chloroethyl)-, diethyl ester
CAS Number:
89215-44-1
Molecular Formula:
C10H16Cl2O4
Molecular Weight:
271.1376
IUPAC Name:
diethyl 2-chloro-2-(2-chloroethyl)butanedioate
InChI:
InChI=1S/C10H16Cl2O4/c1-3-15-8(13)7-10(12,5-6-11)9(14)16-4-2/h3-7H2,1-2H3
InChI Key:
YIXOPDYXQGEORS-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(C(=O)OCC)(CCCl)Cl
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.043g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.134g/mol
Monoisotopic Mass:
270.043g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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