2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol

C13H20O4 — CID 117353557

IUPAC2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol
SMILESCOCc1ccc(OC)c(C(C)(C)O)c1OC
InChIInChI=1S/C13H20O4/c1-13(2,14)11-10(16-4)7-6-9(8-15-3)12(11)17-5/h6-7,14H,8H2,1-5H3
InChIKeyQUSABRMOCNDSKH-UHFFFAOYSA-N
MW240.30 g/mol
LogP2.08
Rot. Bonds5

About 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol

2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol (PubChem CID 117353557) has the molecular formula C13H20O4 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol.

Molecular Properties

Compound Name2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol
PubChem CID117353557
Molecular FormulaC13H20O4
Molecular Weight240.30 g/mol
Exact Mass240.14
IUPAC Name2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol
SMILESCOCc1ccc(OC)c(C(C)(C)O)c1OC
InChIInChI=1S/C13H20O4/c1-13(2,14)11-10(16-4)7-6-9(8-15-3)12(11)17-5/h6-7,14H,8H2,1-5H3
InChIKeyQUSABRMOCNDSKH-UHFFFAOYSA-N
XLogP2.08
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2,6-dimethoxy-3-(methoxymethyl)phenyl]ethanol
CID 117325544
1-methoxy-4-(methoxymethyl)naphthalene
CID 12777030
N-[[2,3-dimethoxy-6-(methoxymethyl)phenyl]methyl]hydroxylamine
CID 84791445
2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol
CID 117300531
3-ethyl-2-(2-hydroxypropan-2-yl)-6-methoxyphenol
CID 84677805
2-(2-bromo-3,6-dimethoxyphenyl)propan-2-ol
CID 117439684
2-(2,3,5,6-tetramethoxyphenyl)propan-2-ol
CID 165348100
1-[3,4-dimethoxy-2-(methoxymethyl)phenyl]propan-2-one
CID 117349006
2-[2,4-dimethoxy-5-(methoxymethyl)phenyl]propan-2-ol
CID 117353561
1-[2,6-dimethoxy-3-(methoxymethyl)phenyl]-2-(methylamino)ethanol
CID 117391377
O-[[2,3-dimethoxy-4-(methoxymethyl)phenyl]methyl]hydroxylamine
CID 117326901
2-[2-methoxy-5-(methoxymethyl)phenyl]propan-2-ol
CID 117300505

Frequently Asked Questions

What is the IUPAC name of 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol?
The IUPAC name of 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol (CID 117353557) is 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol.
What is the SMILES notation for 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol?
The canonical SMILES for 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol is COCc1ccc(OC)c(C(C)(C)O)c1OC.
What is the InChIKey of 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol?
The InChIKey is QUSABRMOCNDSKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O4/c1-13(2,14)11-10(16-4)7-6-9(8-15-3)12(11)17-5/h6-7,14H,8H2,1-5H3.
What are the key properties of 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol?
2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol has a molecular weight of 240.30 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol is sourced from PubChem (CID 117353557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).