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88539-02-0 | Oxirane, 2-ethoxy-2-(4-fluorophenyl)-3,3-dimethyl-
CAS No: 88539-02-0 Catalog No: AG004E5H MDL No:
Product Description
Catalog Number:
AG004E5H
Chemical Name:
Oxirane, 2-ethoxy-2-(4-fluorophenyl)-3,3-dimethyl-
CAS Number:
88539-02-0
Molecular Formula:
C12H15FO2
Molecular Weight:
210.2447
IUPAC Name:
2-ethoxy-2-(4-fluorophenyl)-3,3-dimethyloxirane
InChI:
InChI=1S/C12H15FO2/c1-4-14-12(11(2,3)15-12)9-5-7-10(13)8-6-9/h5-8H,4H2,1-3H3
InChI Key:
QVVIUQOEJIILFE-UHFFFAOYSA-N
SMILES:
CCOC1(OC1(C)C)c1ccc(cc1)F
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.248g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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