(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol

C11H14O3 — CID 67913122

IUPAC(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol
SMILESCOc1cccc(/C=C/CO)c1OC
InChIInChI=1S/C11H14O3/c1-13-10-7-3-5-9(6-4-8-12)11(10)14-2/h3-7,12H,8H2,1-2H3/b6-4+
InChIKeyIMPHFJKKRKRHCI-GQCTYLIASA-N
MW194.23 g/mol
LogP1.71
Rot. Bonds4

About (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol

(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol (PubChem CID 67913122) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol
PubChem CID67913122
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol
SMILESCOc1cccc(/C=C/CO)c1OC
InChIInChI=1S/C11H14O3/c1-13-10-7-3-5-9(6-4-8-12)11(10)14-2/h3-7,12H,8H2,1-2H3/b6-4+
InChIKeyIMPHFJKKRKRHCI-GQCTYLIASA-N
XLogP1.71
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(E)-3-(2-methoxyphenyl)prop-2-en-1-ol
CID 11400969
3-(2,3-dimethoxyphenyl)prop-2-ene-1-thiol
CID 169456447
2-(3-hydroxyprop-1-enyl)-6-methoxybenzoic acid
CID 169453821
3-(2,3-dimethoxyphenyl)-N-ethylprop-2-en-1-amine
CID 79346794
(E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-en-1-ol
CID 163198757
3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol
CID 67414979
(E)-4-(2-methoxyphenyl)but-3-en-1-ol
CID 15330930
(Z)-4-(2-methoxyphenyl)but-3-en-1-ol
CID 11789784
1-[(E)-2-(4-chlorophenyl)ethenyl]-2,3-dimethoxybenzene
CID 138660638
2-[2-ethoxy-6-(3-hydroxyprop-1-enyl)phenoxy]acetic acid
CID 169454343
(E)-3-(2,3-dimethoxyphenyl)-N',N'-dimethylprop-2-enehydrazide
CID 9163798
4-(3-fluoro-2-methoxyphenyl)but-3-en-1-ol
CID 170476426

Frequently Asked Questions

What is the IUPAC name of (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol?
The IUPAC name of (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol (CID 67913122) is (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol.
What is the SMILES notation for (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol?
The canonical SMILES for (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol is COc1cccc(/C=C/CO)c1OC.
What is the InChIKey of (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol?
The InChIKey is IMPHFJKKRKRHCI-GQCTYLIASA-N. The full InChI is InChI=1S/C11H14O3/c1-13-10-7-3-5-9(6-4-8-12)11(10)14-2/h3-7,12H,8H2,1-2H3/b6-4+.
What are the key properties of (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol?
(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol has a molecular weight of 194.23 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol is sourced from PubChem (CID 67913122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).