2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol

C11H14O3 — CID 5352905

IUPAC2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol
SMILESC/C=C/c1cc(OC)c(O)c(OC)c1
InChIInChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4-7,12H,1-3H3/b5-4+
InChIKeyYFHOHYAUMDHSBX-SNAWJCMRSA-N
MW194.23 g/mol
LogP2.44
Rot. Bonds3

About 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol

2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol (PubChem CID 5352905) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol.

Molecular Properties

Compound Name2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol
PubChem CID5352905
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol
SMILESC/C=C/c1cc(OC)c(O)c(OC)c1
InChIInChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4-7,12H,1-3H3/b5-4+
InChIKeyYFHOHYAUMDHSBX-SNAWJCMRSA-N
XLogP2.44
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol?
The IUPAC name of 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol (CID 5352905) is 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol.
What is the SMILES notation for 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol?
The canonical SMILES for 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol is C/C=C/c1cc(OC)c(O)c(OC)c1.
What is the InChIKey of 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol?
The InChIKey is YFHOHYAUMDHSBX-SNAWJCMRSA-N. The full InChI is InChI=1S/C11H14O3/c1-4-5-8-6-9(13-2)11(12)10(7-8)14-3/h4-7,12H,1-3H3/b5-4+.
What are the key properties of 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol?
2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol has a molecular weight of 194.23 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-4-[(E)-prop-1-enyl]phenol is sourced from PubChem (CID 5352905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).