Home Halogens methyl 2,3-dichloro-3-oxopropanoate

methyl 2,3-dichloro-3-oxopropanoate

CAS No.:
60180-62-3
Catalog Number:
AG01BJ2Z
Molecular Formula:
C4H4Cl2O3
Molecular Weight:
170.9788
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Product Description
Catalog Number:
AG01BJ2Z
Chemical Name:
methyl 2,3-dichloro-3-oxopropanoate
CAS Number:
60180-62-3
Molecular Formula:
C4H4Cl2O3
Molecular Weight:
170.9788
MDL Number:
MFCD20623164
IUPAC Name:
methyl 2,3-dichloro-3-oxopropanoate
InChI:
InChI=1S/C4H4Cl2O3/c1-9-4(8)2(5)3(6)7/h2H,1H3
InChI Key:
VGLAESBBSQCKBP-UHFFFAOYSA-N
SMILES:
COC(=O)C(C(=O)Cl)Cl
Properties
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.954g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.973g/mol
Monoisotopic Mass:
169.954g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties