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Home > Fluorides > 144574-27-6
144574-27-6 | Oxirane, 2-[(3,4-difluorophenoxy)methyl]-, (2S)-
CAS No: 144574-27-6 Catalog No: AG001JRD MDL No:
Product Description
Catalog Number:
AG001JRD
Chemical Name:
Oxirane, 2-[(3,4-difluorophenoxy)methyl]-, (2S)-
CAS Number:
144574-27-6
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
IUPAC Name:
(2S)-2-[(3,4-difluorophenoxy)methyl]oxirane
InChI:
InChI=1S/C9H8F2O2/c10-8-2-1-6(3-9(8)11)12-4-7-5-13-7/h1-3,7H,4-5H2/t7-/m1/s1
InChI Key:
IPISVAVLYKMJFL-SSDOTTSWSA-N
SMILES:
Fc1ccc(cc1F)OC[C@@H]1CO1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
186.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.158g/mol
Monoisotopic Mass:
186.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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