4-ethyl-2-hydroxy-6-methylbenzaldehyde

C10H12O2 — CID 150151746

IUPAC4-ethyl-2-hydroxy-6-methylbenzaldehyde
SMILESCCc1cc(C)c(C=O)c(O)c1
InChIInChI=1S/C10H12O2/c1-3-8-4-7(2)9(6-11)10(12)5-8/h4-6,12H,3H2,1-2H3
InChIKeyFFJSJMSDFUBHGQ-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.08
Rot. Bonds2

About 4-ethyl-2-hydroxy-6-methylbenzaldehyde

4-ethyl-2-hydroxy-6-methylbenzaldehyde (PubChem CID 150151746) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 4-ethyl-2-hydroxy-6-methylbenzaldehyde.

Molecular Properties

Compound Name4-ethyl-2-hydroxy-6-methylbenzaldehyde
PubChem CID150151746
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name4-ethyl-2-hydroxy-6-methylbenzaldehyde
SMILESCCc1cc(C)c(C=O)c(O)c1
InChIInChI=1S/C10H12O2/c1-3-8-4-7(2)9(6-11)10(12)5-8/h4-6,12H,3H2,1-2H3
InChIKeyFFJSJMSDFUBHGQ-UHFFFAOYSA-N
XLogP2.08
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.08
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

2,4-dihydroxy-6-methylbenzene-1,3-dicarbaldehyde
CID 601986
5-ethyl-2-fluoro-3-methylphenol
CID 89028057
acetaldehyde;4-ethyl-2-methylphenol
CID 143589394
2-hydroxy-4-methoxy-6-methylbenzaldehyde
CID 596815
5-ethyl-2-hydroxybenzene-1,3-dicarbaldehyde;2-hydroxy-4,5,6-trimethylbenzene-1,3-dicarbaldehyde
CID 159491845
ethane;4-ethyl-2,6-dimethylphenol
CID 143343408
4-ethyl-2,6-dimethylphenol;methane
CID 159618487
4-ethyl-2,6-difluorobenzaldehyde
CID 88881021
4-hydroxy-2,3,6-trimethylbenzaldehyde
CID 11309702
2,4,6-trihydroxybenzaldehyde;2,4,6-trimethylbenzaldehyde
CID 159352487
7-ethyl-2-hydroxynaphthalene-1-carbaldehyde
CID 89338488
3-chloro-2,4-dihydroxy-6-methylbenzaldehyde
CID 71334263

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-hydroxy-6-methylbenzaldehyde?
The IUPAC name of 4-ethyl-2-hydroxy-6-methylbenzaldehyde (CID 150151746) is 4-ethyl-2-hydroxy-6-methylbenzaldehyde.
What is the SMILES notation for 4-ethyl-2-hydroxy-6-methylbenzaldehyde?
The canonical SMILES for 4-ethyl-2-hydroxy-6-methylbenzaldehyde is CCc1cc(C)c(C=O)c(O)c1.
What is the InChIKey of 4-ethyl-2-hydroxy-6-methylbenzaldehyde?
The InChIKey is FFJSJMSDFUBHGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-3-8-4-7(2)9(6-11)10(12)5-8/h4-6,12H,3H2,1-2H3.
What are the key properties of 4-ethyl-2-hydroxy-6-methylbenzaldehyde?
4-ethyl-2-hydroxy-6-methylbenzaldehyde has a molecular weight of 164.20 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-hydroxy-6-methylbenzaldehyde is sourced from PubChem (CID 150151746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).