1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol

C17H18F2O2 — CID 82006560

IUPAC1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol
SMILESOC(Cc1ccccc1)C(OCC(F)F)c1ccccc1
InChIInChI=1S/C17H18F2O2/c18-16(19)12-21-17(14-9-5-2-6-10-14)15(20)11-13-7-3-1-4-8-13/h1-10,15-17,20H,11-12H2
InChIKeyYNVINENGVRGAMX-UHFFFAOYSA-N
MW292.32 g/mol
LogP3.61
Rot. Bonds7

About 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol

1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol (PubChem CID 82006560) has the molecular formula C17H18F2O2 and a molecular weight of 292.32 g/mol. Its IUPAC name is 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol.

Molecular Properties

Compound Name1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol
PubChem CID82006560
Molecular FormulaC17H18F2O2
Molecular Weight292.32 g/mol
Exact Mass292.13
IUPAC Name1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol
SMILESOC(Cc1ccccc1)C(OCC(F)F)c1ccccc1
InChIInChI=1S/C17H18F2O2/c18-16(19)12-21-17(14-9-5-2-6-10-14)15(20)11-13-7-3-1-4-8-13/h1-10,15-17,20H,11-12H2
InChIKeyYNVINENGVRGAMX-UHFFFAOYSA-N
XLogP3.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethoxy-1-phenyl-3-pyridin-4-ylpropan-2-ol
CID 116757045
1,1-difluoro-3-phenylpropan-2-ol
CID 15085378
(1R)-1-fluoro-2-phenylethanol
CID 163366132
(1R)-1,2-diphenylethanol
CID 1379022
3-(3,5-dimethylphenyl)-1-methoxy-1-phenylpropan-2-ol
CID 116757000
3-(2-hydroxypropoxy)-1-phenylbutan-2-ol
CID 19968656
1-methoxy-3-(3-methoxyphenyl)-1-phenylpropan-2-ol
CID 116757004
(1S,2R)-1-amino-1-[3-(difluoromethoxy)phenyl]-3-phenylpropan-2-ol
CID 171268459
(1R,2S)-1-amino-1-[3-fluoro-4-(trifluoromethoxy)phenyl]-3-phenylpropan-2-ol
CID 171263568
2-[4-[(2R,3R)-2-hydroxy-3-phenyl-3-phenylmethoxypropoxy]phenyl]acetaldehyde
CID 90026257
(1R)-2-(4-fluorophenyl)-1-phenylethanol
CID 93312313
1-[4-(difluoromethyl)phenyl]-2-phenylethanol
CID 115524931

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol?
The IUPAC name of 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol (CID 82006560) is 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol.
What is the SMILES notation for 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol?
The canonical SMILES for 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol is OC(Cc1ccccc1)C(OCC(F)F)c1ccccc1.
What is the InChIKey of 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol?
The InChIKey is YNVINENGVRGAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2O2/c18-16(19)12-21-17(14-9-5-2-6-10-14)15(20)11-13-7-3-1-4-8-13/h1-10,15-17,20H,11-12H2.
What are the key properties of 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol?
1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol has a molecular weight of 292.32 g/mol, XLogP of 3.61, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethoxy)-1,3-diphenylpropan-2-ol is sourced from PubChem (CID 82006560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).