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

C15H16O4 — CID 146162008

IUPAC4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol
SMILESCOc1c(C)cc(O)c(-c2ccc(O)cc2O)c1C
InChIInChI=1S/C15H16O4/c1-8-6-13(18)14(9(2)15(8)19-3)11-5-4-10(16)7-12(11)17/h4-7,16-18H,1-3H3
InChIKeyVYJJICISZSBXDD-UHFFFAOYSA-N
MW260.29 g/mol
LogP3.10
Rot. Bonds2

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

4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol (PubChem CID 146162008) has the molecular formula C15H16O4 and a molecular weight of 260.29 g/mol. Its IUPAC name is 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol.

Molecular Properties

Compound Name4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol
PubChem CID146162008
Molecular FormulaC15H16O4
Molecular Weight260.29 g/mol
Exact Mass260.10
IUPAC Name4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol
SMILESCOc1c(C)cc(O)c(-c2ccc(O)cc2O)c1C
InChIInChI=1S/C15H16O4/c1-8-6-13(18)14(9(2)15(8)19-3)11-5-4-10(16)7-12(11)17/h4-7,16-18H,1-3H3
InChIKeyVYJJICISZSBXDD-UHFFFAOYSA-N
XLogP3.10
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol?
The IUPAC name of 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol (CID 146162008) is 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol.
What is the SMILES notation for 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol?
The canonical SMILES for 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol is COc1c(C)cc(O)c(-c2ccc(O)cc2O)c1C.
What is the InChIKey of 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol?
The InChIKey is VYJJICISZSBXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O4/c1-8-6-13(18)14(9(2)15(8)19-3)11-5-4-10(16)7-12(11)17/h4-7,16-18H,1-3H3.
What are the key properties of 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol?
4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol has a molecular weight of 260.29 g/mol, XLogP of 3.10, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-hydroxy-3-methoxy-2,4-dimethylphenyl)benzene-1,3-diol is sourced from PubChem (CID 146162008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).