CC1(C(O1)(C2=CC=C(C=C2)F)OC)C
CAS: 88539-00-8
Name: 2-(4-fluorophenyl)-2-methoxy-3,3-dimethyloxirane
SMILES: CC1(C(O1)(C2=CC=C(C=C2)F)OC)C

Molecular Processing

Molecular formula
C11H13FO2
Molecular weight
196.22
Exact mass
196.09
XLogP
2.43
TPSA
21.76
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
50.25

Supplementary Information

InChIKey: HHLFJOXPWNCPJC-UHFFFAOYSA-N
Synonyme
88539-00-82-(4-Fluorophenyl)-2-methoxy-3,3-dimethyloxirane2-(4-Fluorophenyl)-3,3-dimethyl-2-methoxyoxiraneSCHEMBL2705448DTXSID30518749HHLFJOXPWNCPJC-UHFFFAOYSA-N(4-fluorophenyl)-3,3-dimethyl-2-methoxyoxirane
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