Name: 2-(3-fluoropropyl)butane-1,4-diol
SMILES:
C(CC(CCO)CO)CFMolecular Processing
Molecular formula
C7H15FO2
Molecular weight
150.19
Exact mass
150.1056
XLogP
0.73
TPSA
40.46
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
37.49
Supplementary Information
InChIKey: AZNWTABSYOFHBD-UHFFFAOYSA-N
Synonyme
SCHEMBL7909112AZNWTABSYOFHBD-UHFFFAOYSA-N2-(3-fluoropropyl)-1,4-butanediol
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