3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol

C16H18O2 — CID 101198305

IUPAC3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol
SMILESOCc1ccccc1CC(CO)c1ccccc1
InChIInChI=1S/C16H18O2/c17-11-15-9-5-4-8-14(15)10-16(12-18)13-6-2-1-3-7-13/h1-9,16-18H,10-12H2
InChIKeyFFNLNNFSURISMI-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.50
Rot. Bonds5

About 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol

3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol (PubChem CID 101198305) has the molecular formula C16H18O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol.

Molecular Properties

Compound Name3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol
PubChem CID101198305
Molecular FormulaC16H18O2
Molecular Weight242.32 g/mol
Exact Mass242.13
IUPAC Name3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol
SMILESOCc1ccccc1CC(CO)c1ccccc1
InChIInChI=1S/C16H18O2/c17-11-15-9-5-4-8-14(15)10-16(12-18)13-6-2-1-3-7-13/h1-9,16-18H,10-12H2
InChIKeyFFNLNNFSURISMI-UHFFFAOYSA-N
XLogP2.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,5S)-2,5-diphenylhexane-1,6-diol
CID 102169365
3-(2,5-dichlorophenyl)-2-phenylpropan-1-ol
CID 66059419
3-(2,4-difluorophenyl)-2-phenylpropan-1-ol
CID 66059206
(3-hydroxy-2-phenylpropyl)-λ2-stannane
CID 173264317
[2-(hydroxymethyl)phenyl]methanol;methane
CID 143282166
3-(3-hydroxy-2-phenylpropoxy)-2-phenylpropan-1-ol
CID 56973826
3-(2,4-dichlorophenyl)-2-phenylpropan-1-ol;methanesulfonic acid
CID 88843715
[2-[(2S)-2-aminopropyl]phenyl]methanol
CID 130643067
3-(5-bromo-2-methoxyphenyl)-2-phenylpropan-1-ol
CID 66060063
[2-(2-methylbutyl)phenyl]methanol
CID 66698085
3-(1,3-benzothiazol-2-yl)-2-phenylpropan-1-ol
CID 104632377
sodium;hydride;4-hydroxy-3-phenylbutane-1-sulfonic acid
CID 173165688

Frequently Asked Questions

What is the IUPAC name of 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol?
The IUPAC name of 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol (CID 101198305) is 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol.
What is the SMILES notation for 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol?
The canonical SMILES for 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol is OCc1ccccc1CC(CO)c1ccccc1.
What is the InChIKey of 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol?
The InChIKey is FFNLNNFSURISMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O2/c17-11-15-9-5-4-8-14(15)10-16(12-18)13-6-2-1-3-7-13/h1-9,16-18H,10-12H2.
What are the key properties of 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol?
3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol has a molecular weight of 242.32 g/mol, XLogP of 2.50, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(hydroxymethyl)phenyl]-2-phenylpropan-1-ol is sourced from PubChem (CID 101198305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).