2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol

C11H16O3 — CID 84666960

IUPAC2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol
SMILESCOc1ccc(C(C)C)c(CO)c1O
InChIInChI=1S/C11H16O3/c1-7(2)8-4-5-10(14-3)11(13)9(8)6-12/h4-5,7,12-13H,6H2,1-3H3
InChIKeyLDZJALLRMNPCHM-UHFFFAOYSA-N
MW196.25 g/mol
LogP2.02
Rot. Bonds3

About 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol

2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol (PubChem CID 84666960) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol.

Molecular Properties

Compound Name2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol
PubChem CID84666960
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol
SMILESCOc1ccc(C(C)C)c(CO)c1O
InChIInChI=1S/C11H16O3/c1-7(2)8-4-5-10(14-3)11(13)9(8)6-12/h4-5,7,12-13H,6H2,1-3H3
InChIKeyLDZJALLRMNPCHM-UHFFFAOYSA-N
XLogP2.02
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2,3-dimethoxy-6-propan-2-ylphenyl)methanol
CID 84677822
3-(2-hydroxy-3-methoxy-6-propan-2-ylphenyl)propanal
CID 117318262
(3,6-dimethoxy-2-propan-2-ylphenyl)methanol
CID 84677821
6-(1-hydroxypropan-2-yl)-2,3-dimethoxyphenol
CID 117303009
3-(2-hydroxy-3-methoxy-6-propan-2-ylphenyl)-3-methylbutanoic acid
CID 117419964
2-(2-hydroxyethyl)-3,6-di(propan-2-yl)phenol
CID 117318714
2-bromo-3-(1-hydroxypropyl)-6-methoxyphenol
CID 83951172
2-(2,3-dimethoxy-6-propan-2-ylphenyl)propan-1-ol
CID 117349610
3-(1-aminopropan-2-yl)-2-fluoro-6-methoxyphenol
CID 117288592
2-(2-methoxynaphthalen-1-yl)-6-methyl-3-propan-2-ylphenol
CID 102189709
2-(4-methoxy-2,3-dimethylphenyl)-3-methylbutan-1-ol
CID 116964236
1-(2-ethyl-3,4-dimethoxyphenyl)ethanol
CID 84677809

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol?
The IUPAC name of 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol (CID 84666960) is 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol.
What is the SMILES notation for 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol?
The canonical SMILES for 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol is COc1ccc(C(C)C)c(CO)c1O.
What is the InChIKey of 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol?
The InChIKey is LDZJALLRMNPCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O3/c1-7(2)8-4-5-10(14-3)11(13)9(8)6-12/h4-5,7,12-13H,6H2,1-3H3.
What are the key properties of 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol?
2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol has a molecular weight of 196.25 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-6-methoxy-3-propan-2-ylphenol is sourced from PubChem (CID 84666960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).