Name: 4-(3-fluorophenyl)but-3-en-1-ol
SMILES:
C1=CC(=CC(=C1)F)C=CCCOMolecular Processing
Molecular formula
C10H11FO
Molecular weight
166.19
Exact mass
166.0794
XLogP
2.22
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
47.14
Supplementary Information
InChIKey: AERDUPQOHFIYFC-UHFFFAOYSA-N
Synonyme
SCHEMBL8408908AERDUPQOHFIYFC-UHFFFAOYSA-N4-(3-fluorophenyl)-3-buten-1-ol
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