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34034-87-2

34034-87-2 | Diethyl 2-chloro-3-oxosuccinate

CAS No: 34034-87-2 Catalog No: AG00382E MDL No:MFCD04114359

Product Description

Catalog Number:
AG00382E
Chemical Name:
Diethyl 2-chloro-3-oxosuccinate
CAS Number:
34034-87-2
Molecular Formula:
C8H11ClO5
Molecular Weight:
222.6229
MDL Number:
MFCD04114359
IUPAC Name:
diethyl 2-chloro-3-oxobutanedioate
InChI:
InChI=1S/C8H11ClO5/c1-3-13-7(11)5(9)6(10)8(12)14-4-2/h5H,3-4H2,1-2H3
InChI Key:
JNQWFLVFHCCWPV-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)C(C(=O)OCC)Cl

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.03g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.621g/mol
Monoisotopic Mass:
222.03g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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