1-(2,3,4-trimethylphenyl)ethanol

C11H16O — CID 130125335

IUPAC1-(2,3,4-trimethylphenyl)ethanol
SMILESCc1ccc(C(C)O)c(C)c1C
InChIInChI=1S/C11H16O/c1-7-5-6-11(10(4)12)9(3)8(7)2/h5-6,10,12H,1-4H3
InChIKeyGGQVDHWLZUNKSG-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.67
Rot. Bonds1

About 1-(2,3,4-trimethylphenyl)ethanol

1-(2,3,4-trimethylphenyl)ethanol (PubChem CID 130125335) has the molecular formula C11H16O and a molecular weight of 164.25 g/mol. Its IUPAC name is 1-(2,3,4-trimethylphenyl)ethanol.

Molecular Properties

Compound Name1-(2,3,4-trimethylphenyl)ethanol
PubChem CID130125335
Molecular FormulaC11H16O
Molecular Weight164.25 g/mol
Exact Mass164.12
IUPAC Name1-(2,3,4-trimethylphenyl)ethanol
SMILESCc1ccc(C(C)O)c(C)c1C
InChIInChI=1S/C11H16O/c1-7-5-6-11(10(4)12)9(3)8(7)2/h5-6,10,12H,1-4H3
InChIKeyGGQVDHWLZUNKSG-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethyl-1-(2,3,4-trimethylphenyl)ethanamine
CID 116914689
2-fluoro-6-(1-hydroxyethyl)-3-methylphenol
CID 117276805
1-(4-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)ethanol
CID 117282016
1-[1-(2,4-dimethylphenyl)ethyl]-2,3,4-trimethylbenzene
CID 173435517
2-bromo-3-(1-hydroxyethyl)-6-methylphenol
CID 117333512
N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide
CID 116847102
2,3-bis[3-(2,3,4-trimethylphenyl)butan-2-yl]phenol
CID 67182206
ruthenium;1,2,3,4-tetramethylbenzene
CID 158325243
1-(2,3,4-trimethylphenyl)ethane-1,2-diamine
CID 116855521
1-(2,4-difluoro-3-methylphenyl)ethanol
CID 84654323
3-amino-3-(2,3,4-trimethylphenyl)propanamide
CID 116850990
1-(2-bromo-3-methoxy-4-methylphenyl)ethanol
CID 117364093

Frequently Asked Questions

What is the IUPAC name of 1-(2,3,4-trimethylphenyl)ethanol?
The IUPAC name of 1-(2,3,4-trimethylphenyl)ethanol (CID 130125335) is 1-(2,3,4-trimethylphenyl)ethanol.
What is the SMILES notation for 1-(2,3,4-trimethylphenyl)ethanol?
The canonical SMILES for 1-(2,3,4-trimethylphenyl)ethanol is Cc1ccc(C(C)O)c(C)c1C.
What is the InChIKey of 1-(2,3,4-trimethylphenyl)ethanol?
The InChIKey is GGQVDHWLZUNKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O/c1-7-5-6-11(10(4)12)9(3)8(7)2/h5-6,10,12H,1-4H3.
What are the key properties of 1-(2,3,4-trimethylphenyl)ethanol?
1-(2,3,4-trimethylphenyl)ethanol has a molecular weight of 164.25 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,4-trimethylphenyl)ethanol is sourced from PubChem (CID 130125335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).