2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol

C15H16O3 — CID 101299632

IUPAC2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol
SMILESCc1cc(O)c(-c2c(O)cccc2O)c(C)c1C
InChIInChI=1S/C15H16O3/c1-8-7-13(18)14(10(3)9(8)2)15-11(16)5-4-6-12(15)17/h4-7,16-18H,1-3H3
InChIKeyVCLPULLNCDAHNG-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.40
Rot. Bonds1

About 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol

2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol (PubChem CID 101299632) has the molecular formula C15H16O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol.

Molecular Properties

Compound Name2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol
PubChem CID101299632
Molecular FormulaC15H16O3
Molecular Weight244.29 g/mol
Exact Mass244.11
IUPAC Name2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol
SMILESCc1cc(O)c(-c2c(O)cccc2O)c(C)c1C
InChIInChI=1S/C15H16O3/c1-8-7-13(18)14(10(3)9(8)2)15-11(16)5-4-6-12(15)17/h4-7,16-18H,1-3H3
InChIKeyVCLPULLNCDAHNG-UHFFFAOYSA-N
XLogP3.40
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,2-diol
CID 101299642
1-(6-hydroxy-2,3,4-trimethylphenyl)-7-methylnaphthalen-2-ol
CID 147166844
5-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol
CID 101299652
2-(2,6-dimethylphenyl)-5-methylbenzene-1,3-diol
CID 101299108
4,5-dimethyl-2-(3-methylphenyl)benzene-1,3-diol
CID 101299034
2-(2-hydroxy-6-methylphenyl)-3-methylphenol
CID 10198261
4-(4,6-dihydroxy-2,3-dimethylphenyl)-5,6-dimethylbenzene-1,3-diol
CID 154709162
2-(2,6-dimethylphenyl)-1,3-dimethylbenzene;2-(2-hydroxy-6-methylphenyl)-3-methylphenol
CID 159777739
3,5-dimethyl-2-(3-methylphenyl)benzene-1,4-diol
CID 101299061
3,4,5-trimethylnaphthalen-1-ol
CID 54424732
3,4-dimethylnaphthalen-1-ol
CID 15915434
2-methylbenzene-1,3-diol
CID 139200813

Frequently Asked Questions

What is the IUPAC name of 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol?
The IUPAC name of 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol (CID 101299632) is 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol.
What is the SMILES notation for 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol?
The canonical SMILES for 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol is Cc1cc(O)c(-c2c(O)cccc2O)c(C)c1C.
What is the InChIKey of 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol?
The InChIKey is VCLPULLNCDAHNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3/c1-8-7-13(18)14(10(3)9(8)2)15-11(16)5-4-6-12(15)17/h4-7,16-18H,1-3H3.
What are the key properties of 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol?
2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol has a molecular weight of 244.29 g/mol, XLogP of 3.40, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-hydroxy-2,3,4-trimethylphenyl)benzene-1,3-diol is sourced from PubChem (CID 101299632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).