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834155-49-6 | Cyclopropanecarboxylic acid, 2-fluoro-1-phenyl-, ethyl ester
CAS No: 834155-49-6 Catalog No: AG0054GO MDL No:
Product Description
Catalog Number:
AG0054GO
Chemical Name:
Cyclopropanecarboxylic acid, 2-fluoro-1-phenyl-, ethyl ester
CAS Number:
834155-49-6
Molecular Formula:
C12H13FO2
Molecular Weight:
208.2288
IUPAC Name:
ethyl 2-fluoro-1-phenylcyclopropane-1-carboxylate
InChI:
InChI=1S/C12H13FO2/c1-2-15-11(14)12(8-10(12)13)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3
InChI Key:
MMHWPHDUTLJVFU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CC1F)c1ccccc1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.232g/mol
Monoisotopic Mass:
208.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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