(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol

C12H18O3 — CID 13389492

IUPAC(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol
SMILESCOc1c(C)c(C)c(OC)c(CO)c1C
InChIInChI=1S/C12H18O3/c1-7-8(2)12(15-5)10(6-13)9(3)11(7)14-4/h13H,6H2,1-5H3
InChIKeyXQCGKSRFUNJKJW-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.12
Rot. Bonds3

About (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol

(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol (PubChem CID 13389492) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol.

Molecular Properties

Compound Name(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol
PubChem CID13389492
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol
SMILESCOc1c(C)c(C)c(OC)c(CO)c1C
InChIInChI=1S/C12H18O3/c1-7-8(2)12(15-5)10(6-13)9(3)11(7)14-4/h13H,6H2,1-5H3
InChIKeyXQCGKSRFUNJKJW-UHFFFAOYSA-N
XLogP2.12
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol?
The IUPAC name of (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol (CID 13389492) is (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol.
What is the SMILES notation for (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol?
The canonical SMILES for (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol is COc1c(C)c(C)c(OC)c(CO)c1C.
What is the InChIKey of (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol?
The InChIKey is XQCGKSRFUNJKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-7-8(2)12(15-5)10(6-13)9(3)11(7)14-4/h13H,6H2,1-5H3.
What are the key properties of (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol?
(2,5-dimethoxy-3,4,6-trimethylphenyl)methanol has a molecular weight of 210.27 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxy-3,4,6-trimethylphenyl)methanol is sourced from PubChem (CID 13389492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).