1,1-bis(2-fluorophenyl)propan-1-ol

C15H14F2O — CID 112679425

IUPAC1,1-bis(2-fluorophenyl)propan-1-ol
SMILESCCC(O)(c1ccccc1F)c1ccccc1F
InChIInChI=1S/C15H14F2O/c1-2-15(18,11-7-3-5-9-13(11)16)12-8-4-6-10-14(12)17/h3-10,18H,2H2,1H3
InChIKeyMMAQAODXEVFGIX-UHFFFAOYSA-N
MW248.27 g/mol
LogP3.61
Rot. Bonds3

About 1,1-bis(2-fluorophenyl)propan-1-ol

1,1-bis(2-fluorophenyl)propan-1-ol (PubChem CID 112679425) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1,1-bis(2-fluorophenyl)propan-1-ol.

Molecular Properties

Compound Name1,1-bis(2-fluorophenyl)propan-1-ol
PubChem CID112679425
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1,1-bis(2-fluorophenyl)propan-1-ol
SMILESCCC(O)(c1ccccc1F)c1ccccc1F
InChIInChI=1S/C15H14F2O/c1-2-15(18,11-7-3-5-9-13(11)16)12-8-4-6-10-14(12)17/h3-10,18H,2H2,1H3
InChIKeyMMAQAODXEVFGIX-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-fluorophenyl)-1-(4-methylphenyl)propan-1-ol
CID 112679383
1-(2-fluorophenyl)-1-(3-fluoro-4-pyridinyl)propan-1-ol
CID 104737726
2-amino-1,1-bis(2-fluorophenyl)ethanol
CID 139948069
1-(2,6-difluorophenyl)-2-(2-fluorophenyl)butan-2-ol
CID 114931152
5-ethyl-3-(2-fluorophenyl)heptan-3-ol
CID 112679496
1-(2-fluorophenyl)-1,2-diphenylethanol
CID 66572227
1-cyclopropyl-1-(2-fluorophenyl)propan-1-ol
CID 64918927
1-(2-fluorophenyl)-1-(1-propylpyrazol-4-yl)propan-1-ol
CID 112679355
3-(2-fluorophenyl)-7,7-dimethyloctan-3-ol
CID 114209768
1-(2,4-difluorophenyl)-1-phenylpropan-1-ol
CID 62800875
1-(2,3-difluorophenyl)-2-(2-fluorophenyl)butan-2-ol
CID 115996284
1-(2,3-dichlorophenyl)-2-(2-fluorophenyl)butan-2-ol
CID 107307633

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(2-fluorophenyl)propan-1-ol?
The IUPAC name of 1,1-bis(2-fluorophenyl)propan-1-ol (CID 112679425) is 1,1-bis(2-fluorophenyl)propan-1-ol.
What is the SMILES notation for 1,1-bis(2-fluorophenyl)propan-1-ol?
The canonical SMILES for 1,1-bis(2-fluorophenyl)propan-1-ol is CCC(O)(c1ccccc1F)c1ccccc1F.
What is the InChIKey of 1,1-bis(2-fluorophenyl)propan-1-ol?
The InChIKey is MMAQAODXEVFGIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-2-15(18,11-7-3-5-9-13(11)16)12-8-4-6-10-14(12)17/h3-10,18H,2H2,1H3.
What are the key properties of 1,1-bis(2-fluorophenyl)propan-1-ol?
1,1-bis(2-fluorophenyl)propan-1-ol has a molecular weight of 248.27 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(2-fluorophenyl)propan-1-ol is sourced from PubChem (CID 112679425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).