2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde

C15H14O2 — CID 139758030

IUPAC2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde
SMILESCc1ccc(C=O)c(-c2c(C)cccc2O)c1
InChIInChI=1S/C15H14O2/c1-10-6-7-12(9-16)13(8-10)15-11(2)4-3-5-14(15)17/h3-9,17H,1-2H3
InChIKeyCHSXLIJITXLHHN-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.49
Rot. Bonds2

About 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde

2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde (PubChem CID 139758030) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde.

Molecular Properties

Compound Name2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde
PubChem CID139758030
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde
SMILESCc1ccc(C=O)c(-c2c(C)cccc2O)c1
InChIInChI=1S/C15H14O2/c1-10-6-7-12(9-16)13(8-10)15-11(2)4-3-5-14(15)17/h3-9,17H,1-2H3
InChIKeyCHSXLIJITXLHHN-UHFFFAOYSA-N
XLogP3.49
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2,6-dimethoxyphenyl)-4-methylbenzaldehyde
CID 116810900
3-formyl-2-(2-formyl-5-methylphenyl)-6-methylbenzenesulfonic acid
CID 56623796
3-hydroxy-2-(4-methylphenyl)benzaldehyde
CID 22125800
2,4-dimethylbenzaldehyde;2-hydroxy-4-methylbenzaldehyde;methane
CID 161019797
benzene-1,2-diol;2-hydroxy-5-methylbenzaldehyde
CID 175246423
3,4,8-trimethylazulene-1-carbaldehyde
CID 23256998
2-(2-hydroxy-6-methylphenyl)-3-methylphenol
CID 10198261
2-hydroxy-5-methylbenzaldehyde;3-methylphenol
CID 87684857
2-iodyl-4-methylbenzaldehyde
CID 172555476
3,8-dimethylazulen-4-ol
CID 11557365
2-hydroxy-3-(4-methylphenyl)benzaldehyde
CID 22507827
2-(4-methoxy-3,5-dimethylphenyl)-4-methylbenzaldehyde
CID 83068040

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde?
The IUPAC name of 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde (CID 139758030) is 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde.
What is the SMILES notation for 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde?
The canonical SMILES for 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde is Cc1ccc(C=O)c(-c2c(C)cccc2O)c1.
What is the InChIKey of 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde?
The InChIKey is CHSXLIJITXLHHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-10-6-7-12(9-16)13(8-10)15-11(2)4-3-5-14(15)17/h3-9,17H,1-2H3.
What are the key properties of 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde?
2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde has a molecular weight of 226.28 g/mol, XLogP of 3.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-6-methylphenyl)-4-methylbenzaldehyde is sourced from PubChem (CID 139758030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).