Home Halogens ethyl 6-chloro-3-oxohexanoate

ethyl 6-chloro-3-oxohexanoate

CAS No.:
54362-87-7
Catalog Number:
AG01B76E
Molecular Formula:
C8H13ClO3
Molecular Weight:
192.6400
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Product Description
Catalog Number:
AG01B76E
Chemical Name:
ethyl 6-chloro-3-oxohexanoate
CAS Number:
54362-87-7
Molecular Formula:
C8H13ClO3
Molecular Weight:
192.6400
MDL Number:
MFCD20621668
IUPAC Name:
ethyl 6-chloro-3-oxohexanoate
InChI:
InChI=1S/C8H13ClO3/c1-2-12-8(11)6-7(10)4-3-5-9/h2-6H2,1H3
InChI Key:
YFDQPUOWFBNCSJ-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)CC(=O)OCC
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.055g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.639g/mol
Monoisotopic Mass:
192.055g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties