2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol

C12H18O3 — CID 117300531

IUPAC2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol
SMILESCOc1ccc(C)c(C(C)(C)O)c1OC
InChIInChI=1S/C12H18O3/c1-8-6-7-9(14-4)11(15-5)10(8)12(2,3)13/h6-7,13H,1-5H3
InChIKeyBSMVXJYLKGSOMW-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.24
Rot. Bonds3

About 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol

2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol (PubChem CID 117300531) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol
PubChem CID117300531
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol
SMILESCOc1ccc(C)c(C(C)(C)O)c1OC
InChIInChI=1S/C12H18O3/c1-8-6-7-9(14-4)11(15-5)10(8)12(2,3)13/h6-7,13H,1-5H3
InChIKeyBSMVXJYLKGSOMW-UHFFFAOYSA-N
XLogP2.24
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 ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3,5,6-tetramethoxyphenyl)propan-2-ol
CID 165348100
ethane;1,2,3-trimethoxy-4-methylbenzene
CID 142152701
2-(2-bromo-3,6-dimethoxyphenyl)propan-2-ol
CID 117439684
2-[2,6-dimethoxy-3-(methoxymethyl)phenyl]propan-2-ol
CID 117353557
2-(3-chloro-2-methoxy-4,6-dimethylphenyl)propan-2-ol
CID 117329674
2-(4-bromo-2,3-dimethoxy-6-methylphenyl)propan-2-ol
CID 117466975
3-iodo-1,2-dimethoxy-4-methylbenzene
CID 131118438
2-(3,4-dimethoxy-5-methylphenyl)propan-2-ol
CID 117300512
1-(2,3-dimethoxy-6-methylphenyl)ethanol
CID 84666952
ethane;2-(3-methoxy-4-methylphenyl)propan-2-ol
CID 145081687
2-(3-bromo-2-fluoro-5,6-dimethoxyphenyl)propan-2-ol
CID 117473013
1,2,8-trimethoxy-7-methylnaphthalene
CID 53254661

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol?
The IUPAC name of 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol (CID 117300531) is 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol.
What is the SMILES notation for 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol?
The canonical SMILES for 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol is COc1ccc(C)c(C(C)(C)O)c1OC.
What is the InChIKey of 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol?
The InChIKey is BSMVXJYLKGSOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1-8-6-7-9(14-4)11(15-5)10(8)12(2,3)13/h6-7,13H,1-5H3.
What are the key properties of 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol?
2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol has a molecular weight of 210.27 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethoxy-6-methylphenyl)propan-2-ol is sourced from PubChem (CID 117300531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).