3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol

C14H14O3 — CID 53220760

IUPAC3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol
SMILESCOc1cc(O)cc(-c2cccc(CO)c2)c1
InChIInChI=1S/C14H14O3/c1-17-14-7-12(6-13(16)8-14)11-4-2-3-10(5-11)9-15/h2-8,15-16H,9H2,1H3
InChIKeyYOVHCIDRXCRIIP-UHFFFAOYSA-N
MW230.26 g/mol
LogP2.56
Rot. Bonds3

About 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol

3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol (PubChem CID 53220760) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol.

Molecular Properties

Compound Name3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol
PubChem CID53220760
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol
SMILESCOc1cc(O)cc(-c2cccc(CO)c2)c1
InChIInChI=1S/C14H14O3/c1-17-14-7-12(6-13(16)8-14)11-4-2-3-10(5-11)9-15/h2-8,15-16H,9H2,1H3
InChIKeyYOVHCIDRXCRIIP-UHFFFAOYSA-N
XLogP2.56
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methoxyphenyl)(113C)methanol
CID 11593446
3-(4-ethylphenyl)-5-methoxyphenol
CID 53220748
3-(3-methoxyphenyl)-5-methylphenol
CID 53218837
3-methoxy-5-naphthalen-2-ylphenol
CID 53220916
[3-(5-methoxypyrimidin-2-yl)phenyl]methanol
CID 155039512
2-hydroxy-5-[3-(hydroxymethyl)phenyl]-3-methoxybenzaldehyde
CID 59599926
[3-ethyl-5-(3-phenylmethoxyphenyl)phenyl]methanol
CID 122435033
3-methoxy-5-thiophen-3-ylphenol
CID 53220697
[3-(3,4,5-trifluorophenyl)phenyl]methanol
CID 172650671
[3-(5-tert-butyl-2-methoxyphenyl)phenyl]methanol
CID 176513454
methoxymethane;(3-methoxyphenyl)methanol;prop-1-ene
CID 91163567
[3-(6-methoxypyridazin-3-yl)phenyl]methanol
CID 53425314

Frequently Asked Questions

What is the IUPAC name of 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol?
The IUPAC name of 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol (CID 53220760) is 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol.
What is the SMILES notation for 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol?
The canonical SMILES for 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol is COc1cc(O)cc(-c2cccc(CO)c2)c1.
What is the InChIKey of 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol?
The InChIKey is YOVHCIDRXCRIIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O3/c1-17-14-7-12(6-13(16)8-14)11-4-2-3-10(5-11)9-15/h2-8,15-16H,9H2,1H3.
What are the key properties of 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol?
3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol has a molecular weight of 230.26 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(hydroxymethyl)phenyl]-5-methoxyphenol is sourced from PubChem (CID 53220760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).