[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol

C15H16O3 — CID 54499676

IUPAC[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol
SMILESOCc1cccc(OCc2ccccc2)c1CO
InChIInChI=1S/C15H16O3/c16-9-13-7-4-8-15(14(13)10-17)18-11-12-5-2-1-3-6-12/h1-8,16-17H,9-11H2
InChIKeyYBOFYEVSDXTITK-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.25
Rot. Bonds5

About [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol

[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol (PubChem CID 54499676) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol.

Molecular Properties

Compound Name[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol
PubChem CID54499676
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol
SMILESOCc1cccc(OCc2ccccc2)c1CO
InChIInChI=1S/C15H16O3/c16-9-13-7-4-8-15(14(13)10-17)18-11-12-5-2-1-3-6-12/h1-8,16-17H,9-11H2
InChIKeyYBOFYEVSDXTITK-UHFFFAOYSA-N
XLogP2.25
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methyl-3-phenylmethoxyphenyl)methanol
CID 58087471
ethane;(2-methyl-3-phenylmethoxyphenyl)methanol
CID 143384106
[2,6-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methanol
CID 101008055
2-(aminomethyl)-6-phenylmethoxyphenol
CID 117330545
[2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 887273
(2-fluoro-6-phenylmethoxyphenyl)methanamine
CID 23071556
(4,5-difluoro-2-phenylmethoxyphenyl)methanol
CID 130119023
2-(2-methyl-6-phenylmethoxyphenyl)acetic acid
CID 14519888
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
CID 964391
(4,5-dimethoxy-2-phenylmethoxyphenyl)methanol
CID 53441132
2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol
CID 107712248
(2,4-dichloro-5-phenylmethoxyphenyl)methanol
CID 57425039

Frequently Asked Questions

What is the IUPAC name of [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol?
The IUPAC name of [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol (CID 54499676) is [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol.
What is the SMILES notation for [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol?
The canonical SMILES for [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol is OCc1cccc(OCc2ccccc2)c1CO.
What is the InChIKey of [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol?
The InChIKey is YBOFYEVSDXTITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c16-9-13-7-4-8-15(14(13)10-17)18-11-12-5-2-1-3-6-12/h1-8,16-17H,9-11H2.
What are the key properties of [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol?
[2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol has a molecular weight of 244.29 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(hydroxymethyl)-3-phenylmethoxyphenyl]methanol is sourced from PubChem (CID 54499676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).