2,3-dimethoxy-5,6-dimethylphenol

C10H14O3 — CID 53405608

IUPAC2,3-dimethoxy-5,6-dimethylphenol
SMILESCOc1cc(C)c(C)c(O)c1OC
InChIInChI=1S/C10H14O3/c1-6-5-8(12-3)10(13-4)9(11)7(6)2/h5,11H,1-4H3
InChIKeyMDYQCWHWONEPHA-UHFFFAOYSA-N
MW182.22 g/mol
LogP2.03
Rot. Bonds2

About 2,3-dimethoxy-5,6-dimethylphenol

2,3-dimethoxy-5,6-dimethylphenol (PubChem CID 53405608) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 2,3-dimethoxy-5,6-dimethylphenol.

Molecular Properties

Compound Name2,3-dimethoxy-5,6-dimethylphenol
PubChem CID53405608
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name2,3-dimethoxy-5,6-dimethylphenol
SMILESCOc1cc(C)c(C)c(O)c1OC
InChIInChI=1S/C10H14O3/c1-6-5-8(12-3)10(13-4)9(11)7(6)2/h5,11H,1-4H3
InChIKeyMDYQCWHWONEPHA-UHFFFAOYSA-N
XLogP2.03
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-5,6-dimethylphenol?
The IUPAC name of 2,3-dimethoxy-5,6-dimethylphenol (CID 53405608) is 2,3-dimethoxy-5,6-dimethylphenol.
What is the SMILES notation for 2,3-dimethoxy-5,6-dimethylphenol?
The canonical SMILES for 2,3-dimethoxy-5,6-dimethylphenol is COc1cc(C)c(C)c(O)c1OC.
What is the InChIKey of 2,3-dimethoxy-5,6-dimethylphenol?
The InChIKey is MDYQCWHWONEPHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c1-6-5-8(12-3)10(13-4)9(11)7(6)2/h5,11H,1-4H3.
What are the key properties of 2,3-dimethoxy-5,6-dimethylphenol?
2,3-dimethoxy-5,6-dimethylphenol has a molecular weight of 182.22 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-5,6-dimethylphenol is sourced from PubChem (CID 53405608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).