1,1,3-triphenylpropan-1-ol

C21H20O — CID 4070833

IUPAC1,1,3-triphenylpropan-1-ol
SMILESOC(CCc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H20O/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15,22H,16-17H2
InChIKeyNRTKLWOWRLGLDO-UHFFFAOYSA-N
MW288.39 g/mol
LogP4.56
Rot. Bonds5

About 1,1,3-triphenylpropan-1-ol

1,1,3-triphenylpropan-1-ol (PubChem CID 4070833) has the molecular formula C21H20O and a molecular weight of 288.39 g/mol. Its IUPAC name is 1,1,3-triphenylpropan-1-ol.

Molecular Properties

Compound Name1,1,3-triphenylpropan-1-ol
PubChem CID4070833
Molecular FormulaC21H20O
Molecular Weight288.39 g/mol
Exact Mass288.15
IUPAC Name1,1,3-triphenylpropan-1-ol
SMILESOC(CCc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H20O/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15,22H,16-17H2
InChIKeyNRTKLWOWRLGLDO-UHFFFAOYSA-N
XLogP4.56
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,3-triphenylpropan-1-ol?
The IUPAC name of 1,1,3-triphenylpropan-1-ol (CID 4070833) is 1,1,3-triphenylpropan-1-ol.
What is the SMILES notation for 1,1,3-triphenylpropan-1-ol?
The canonical SMILES for 1,1,3-triphenylpropan-1-ol is OC(CCc1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 1,1,3-triphenylpropan-1-ol?
The InChIKey is NRTKLWOWRLGLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15,22H,16-17H2.
What are the key properties of 1,1,3-triphenylpropan-1-ol?
1,1,3-triphenylpropan-1-ol has a molecular weight of 288.39 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-triphenylpropan-1-ol is sourced from PubChem (CID 4070833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).