CC1=C2C(=C(C=C1)O)OC(O2)(F)F
名称: 2,2-difluoro-7-methyl-1,3-benzodioxol-4-ol
SMILES: CC1=C2C(=C(C=C1)O)OC(O2)(F)F

Molecular Processing

Molecular formula
C8H6F2O3
Molecular weight
188.13
Exact mass
188.0285
XLogP
2.02
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
39.05

Supplementary Information

InChIKey: MUDKESLDHILWRK-UHFFFAOYSA-N
同義語
2,2-difluoro-7-methyl-1,3-benzodioxol-4-olSCHEMBL9904289
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