3-(3,5-difluorophenyl)cyclohex-2-en-1-ol

C12H12F2O — CID 65177157

IUPAC3-(3,5-difluorophenyl)cyclohex-2-en-1-ol
SMILESOC1C=C(c2cc(F)cc(F)c2)CCC1
InChIInChI=1S/C12H12F2O/c13-10-4-9(5-11(14)7-10)8-2-1-3-12(15)6-8/h4-7,12,15H,1-3H2
InChIKeyQPVDXFZGVMEWPA-UHFFFAOYSA-N
MW210.22 g/mol
LogP2.89
Rot. Bonds1

About 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol

3-(3,5-difluorophenyl)cyclohex-2-en-1-ol (PubChem CID 65177157) has the molecular formula C12H12F2O and a molecular weight of 210.22 g/mol. Its IUPAC name is 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name3-(3,5-difluorophenyl)cyclohex-2-en-1-ol
PubChem CID65177157
Molecular FormulaC12H12F2O
Molecular Weight210.22 g/mol
Exact Mass210.09
IUPAC Name3-(3,5-difluorophenyl)cyclohex-2-en-1-ol
SMILESOC1C=C(c2cc(F)cc(F)c2)CCC1
InChIInChI=1S/C12H12F2O/c13-10-4-9(5-11(14)7-10)8-2-1-3-12(15)6-8/h4-7,12,15H,1-3H2
InChIKeyQPVDXFZGVMEWPA-UHFFFAOYSA-N
XLogP2.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.22
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol?
The IUPAC name of 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol (CID 65177157) is 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol.
What is the SMILES notation for 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol?
The canonical SMILES for 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol is OC1C=C(c2cc(F)cc(F)c2)CCC1.
What is the InChIKey of 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol?
The InChIKey is QPVDXFZGVMEWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2O/c13-10-4-9(5-11(14)7-10)8-2-1-3-12(15)6-8/h4-7,12,15H,1-3H2.
What are the key properties of 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol?
3-(3,5-difluorophenyl)cyclohex-2-en-1-ol has a molecular weight of 210.22 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-difluorophenyl)cyclohex-2-en-1-ol is sourced from PubChem (CID 65177157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).