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207279-36-5 | Cyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, ethyl ester, (1R,2R)-
CAS No: 207279-36-5 Catalog No: AG002IXR MDL No:
Product Description
Catalog Number:
AG002IXR
Chemical Name:
Cyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, ethyl ester, (1R,2R)-
CAS Number:
207279-36-5
Molecular Formula:
C12H13ClO2
Molecular Weight:
224.6834
IUPAC Name:
ethyl (1R,2R)-2-(4-chlorophenyl)cyclopropane-1-carboxylate
InChI:
InChI=1S/C12H13ClO2/c1-2-15-12(14)11-7-10(11)8-3-5-9(13)6-4-8/h3-6,10-11H,2,7H2,1H3/t10-,11+/m0/s1
InChI Key:
MBJPATUIODMIKJ-WDEREUQCSA-N
SMILES:
CCOC(=O)[C@@H]1C[C@H]1c1ccc(cc1)Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
224.06g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.684g/mol
Monoisotopic Mass:
224.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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