(2-hydroxy-4-methylphenyl) formate

C8H8O3 — CID 58909986

IUPAC(2-hydroxy-4-methylphenyl) formate
SMILESCc1ccc(OC=O)c(O)c1
InChIInChI=1S/C8H8O3/c1-6-2-3-8(11-5-9)7(10)4-6/h2-5,10H,1H3
InChIKeyLDQHJDVIBBBSCI-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.24
Rot. Bonds2

About (2-hydroxy-4-methylphenyl) formate

(2-hydroxy-4-methylphenyl) formate (PubChem CID 58909986) has the molecular formula C8H8O3 and a molecular weight of 152.15 g/mol. Its IUPAC name is (2-hydroxy-4-methylphenyl) formate.

Molecular Properties

Compound Name(2-hydroxy-4-methylphenyl) formate
PubChem CID58909986
Molecular FormulaC8H8O3
Molecular Weight152.15 g/mol
Exact Mass152.05
IUPAC Name(2-hydroxy-4-methylphenyl) formate
SMILESCc1ccc(OC=O)c(O)c1
InChIInChI=1S/C8H8O3/c1-6-2-3-8(11-5-9)7(10)4-6/h2-5,10H,1H3
InChIKeyLDQHJDVIBBBSCI-UHFFFAOYSA-N
XLogP1.24
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze (2-hydroxy-4-methylphenyl) formate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-hydroxy-4-(trifluoromethyl)phenyl] formate
CID 170010635
2-aminooxy-5-methylphenol;ethane
CID 144810580
(2-hydroxy-4-methylphenyl) hydrogen sulfate
CID 54104170
(3-hydroxy-2-methylphenyl) formate
CID 153313230
[2-[(2-formyloxy-5-methylphenyl)methyl]-4-methylphenoxy]phosphinous acid
CID 130271117
[2-(cyanomethoxy)-4-methylphenyl] formate
CID 174830177
[2-(4-bromophenoxy)-4-methylphenyl] formate
CID 135130123
[4-(2-formamidoethyl)-2-hydroxyphenyl] formate
CID 88543683
2,5-dimethylphenol;ethane
CID 143419778
bis(2,5-dimethylphenol);dihydrochloride
CID 70596946
2,5-dimethylphenol;samarium
CID 87732062
2-(2-methoxyethoxy)-5-methylphenol
CID 89108915

Frequently Asked Questions

What is the IUPAC name of (2-hydroxy-4-methylphenyl) formate?
The IUPAC name of (2-hydroxy-4-methylphenyl) formate (CID 58909986) is (2-hydroxy-4-methylphenyl) formate.
What is the SMILES notation for (2-hydroxy-4-methylphenyl) formate?
The canonical SMILES for (2-hydroxy-4-methylphenyl) formate is Cc1ccc(OC=O)c(O)c1.
What is the InChIKey of (2-hydroxy-4-methylphenyl) formate?
The InChIKey is LDQHJDVIBBBSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O3/c1-6-2-3-8(11-5-9)7(10)4-6/h2-5,10H,1H3.
What are the key properties of (2-hydroxy-4-methylphenyl) formate?
(2-hydroxy-4-methylphenyl) formate has a molecular weight of 152.15 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxy-4-methylphenyl) formate is sourced from PubChem (CID 58909986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).