(1S)-1,2,2-triphenylethanol

C20H18O — CID 38988933

IUPAC(1S)-1,2,2-triphenylethanol
SMILESO[C@H](c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18O/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19-21H/t20-/m1/s1
InChIKeyVNQNLCDOGBOKPL-HXUWFJFHSA-N
MW274.36 g/mol
LogP4.55
Rot. Bonds4

About (1S)-1,2,2-triphenylethanol

(1S)-1,2,2-triphenylethanol (PubChem CID 38988933) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is (1S)-1,2,2-triphenylethanol.

Molecular Properties

Compound Name(1S)-1,2,2-triphenylethanol
PubChem CID38988933
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Name(1S)-1,2,2-triphenylethanol
SMILESO[C@H](c1ccccc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H18O/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19-21H/t20-/m1/s1
InChIKeyVNQNLCDOGBOKPL-HXUWFJFHSA-N
XLogP4.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-diphenylethane-1,2-diol
CID 159073808
1,2,3-triphenylpropane-1,3-diol
CID 59738959
1-[4-(1,2-dihydroxy-2-phenylethyl)phenyl]-2-phenylethane-1,2-diol
CID 14066931
(1R)-2,2-difluoro-1-phenylethanol
CID 12955760
benzene;2-phenylethane-1,1,2-triol
CID 174439943
2,3,3-triphenylpropane-1,1-diol
CID 57157507
(1R,2S,3S,4S,5S,6R)-1,6-diphenylhexane-1,2,3,4,5,6-hexol
CID 134931219
(1R)-2-chloro-2-fluoro-1-phenylethanol
CID 102153591
1-(furan-2-yl)-2,2-diphenylethanol
CID 63947549
(1R,2S)-2-(15N)azanyl-1,2-diphenylethanol
CID 11745978
(1S,2R)-2-amino-1,2-diphenylethanol
CID 719822
(1R,2R)-2-(1H-indol-3-yl)-1,2-diphenylethanol
CID 15981834

Frequently Asked Questions

What is the IUPAC name of (1S)-1,2,2-triphenylethanol?
The IUPAC name of (1S)-1,2,2-triphenylethanol (CID 38988933) is (1S)-1,2,2-triphenylethanol.
What is the SMILES notation for (1S)-1,2,2-triphenylethanol?
The canonical SMILES for (1S)-1,2,2-triphenylethanol is O[C@H](c1ccccc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of (1S)-1,2,2-triphenylethanol?
The InChIKey is VNQNLCDOGBOKPL-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H18O/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15,19-21H/t20-/m1/s1.
What are the key properties of (1S)-1,2,2-triphenylethanol?
(1S)-1,2,2-triphenylethanol has a molecular weight of 274.36 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1,2,2-triphenylethanol is sourced from PubChem (CID 38988933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).