Home Halogens methyl 5-chloro-2-oxopentanoate

methyl 5-chloro-2-oxopentanoate

CAS No.:
1803596-87-3
Catalog Number:
AG01B9UZ
Molecular Formula:
C6H9ClO3
Molecular Weight:
164.5869
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Product Description
Catalog Number:
AG01B9UZ
Chemical Name:
methyl 5-chloro-2-oxopentanoate
CAS Number:
1803596-87-3
Molecular Formula:
C6H9ClO3
Molecular Weight:
164.5869
MDL Number:
MFCD28384001
IUPAC Name:
methyl 5-chloro-2-oxopentanoate
InChI:
InChI=1S/C6H9ClO3/c1-10-6(9)5(8)3-2-4-7/h2-4H2,1H3
InChI Key:
SEGRCTRIKUJTNE-UHFFFAOYSA-N
SMILES:
COC(=O)C(=O)CCCCl
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.024g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.585g/mol
Monoisotopic Mass:
164.024g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties