(3-hydroxy-2-methylphenyl) formate

C8H8O3 — CID 153313230

IUPAC(3-hydroxy-2-methylphenyl) formate
SMILESCc1c(O)cccc1OC=O
InChIInChI=1S/C8H8O3/c1-6-7(10)3-2-4-8(6)11-5-9/h2-5,10H,1H3
InChIKeyHJEFXXQTQJTASX-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.24
Rot. Bonds2

About (3-hydroxy-2-methylphenyl) formate

(3-hydroxy-2-methylphenyl) formate (PubChem CID 153313230) has the molecular formula C8H8O3 and a molecular weight of 152.15 g/mol. Its IUPAC name is (3-hydroxy-2-methylphenyl) formate.

Molecular Properties

Compound Name(3-hydroxy-2-methylphenyl) formate
PubChem CID153313230
Molecular FormulaC8H8O3
Molecular Weight152.15 g/mol
Exact Mass152.05
IUPAC Name(3-hydroxy-2-methylphenyl) formate
SMILESCc1c(O)cccc1OC=O
InChIInChI=1S/C8H8O3/c1-6-7(10)3-2-4-8(6)11-5-9/h2-5,10H,1H3
InChIKeyHJEFXXQTQJTASX-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'}

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Related Compounds

2-(3-hydroxy-2-methylphenoxy)acetaldehyde
CID 86739690
(2-amino-3-methylphenyl) formate
CID 163024542
(2-hydroxy-4-methylphenyl) formate
CID 58909986
2-methylbenzene-1,3-diol
CID 139200813
(5-methoxynaphthalen-1-yl) formate
CID 11447000
2,3-dimethylphenol;bis(2-methylphenol)
CID 67655814
3-(2-aminoethoxy)-2-methylphenol
CID 83620006
[2-(4-methylphenyl)phenyl] formate
CID 1392745
[3-methyl-2-(2-methyl-4-oxopentan-2-yl)phenyl] formate
CID 170949266
(1,4-dihydroxynaphthalen-2-yl) formate
CID 174428973
2-methyl-3-(1-propan-2-yloxyethoxy)phenol
CID 69410619
2-methyl-3-pyridin-4-yloxyphenol
CID 60871245

Frequently Asked Questions

What is the IUPAC name of (3-hydroxy-2-methylphenyl) formate?
The IUPAC name of (3-hydroxy-2-methylphenyl) formate (CID 153313230) is (3-hydroxy-2-methylphenyl) formate.
What is the SMILES notation for (3-hydroxy-2-methylphenyl) formate?
The canonical SMILES for (3-hydroxy-2-methylphenyl) formate is Cc1c(O)cccc1OC=O.
What is the InChIKey of (3-hydroxy-2-methylphenyl) formate?
The InChIKey is HJEFXXQTQJTASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O3/c1-6-7(10)3-2-4-8(6)11-5-9/h2-5,10H,1H3.
What are the key properties of (3-hydroxy-2-methylphenyl) formate?
(3-hydroxy-2-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 (3-hydroxy-2-methylphenyl) formate is sourced from PubChem (CID 153313230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).