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155051-93-7 | Cyclopropanecarboxylic acid, 2-chloro-2-fluoro-, ethyl ester
CAS No: 155051-93-7 Catalog No: AG001NKS MDL No:
Product Description
Catalog Number:
AG001NKS
Chemical Name:
Cyclopropanecarboxylic acid, 2-chloro-2-fluoro-, ethyl ester
CAS Number:
155051-93-7
Molecular Formula:
C6H8ClFO2
Molecular Weight:
166.5779
IUPAC Name:
ethyl 2-chloro-2-fluorocyclopropane-1-carboxylate
InChI:
InChI=1S/C6H8ClFO2/c1-2-10-5(9)4-3-6(4,7)8/h4H,2-3H2,1H3
InChI Key:
BPHKGPOPPUFFMG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CC1(F)Cl
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.02g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.576g/mol
Monoisotopic Mass:
166.02g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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