(E)-1-methoxy-2-(2-methylphenyl)ethenol

C10H12O2 — CID 135049956

IUPAC(E)-1-methoxy-2-(2-methylphenyl)ethenol
SMILESCO/C(O)=C/c1ccccc1C
InChIInChI=1S/C10H12O2/c1-8-5-3-4-6-9(8)7-10(11)12-2/h3-7,11H,1-2H3/b10-7+
InChIKeySIOGUZDQQUENBO-JXMROGBWSA-N
MW164.20 g/mol
LogP2.50
Rot. Bonds2

About (E)-1-methoxy-2-(2-methylphenyl)ethenol

(E)-1-methoxy-2-(2-methylphenyl)ethenol (PubChem CID 135049956) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is (E)-1-methoxy-2-(2-methylphenyl)ethenol.

Molecular Properties

Compound Name(E)-1-methoxy-2-(2-methylphenyl)ethenol
PubChem CID135049956
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name(E)-1-methoxy-2-(2-methylphenyl)ethenol
SMILESCO/C(O)=C/c1ccccc1C
InChIInChI=1S/C10H12O2/c1-8-5-3-4-6-9(8)7-10(11)12-2/h3-7,11H,1-2H3/b10-7+
InChIKeySIOGUZDQQUENBO-JXMROGBWSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-methoxy-2-(2-methylphenyl)ethenol?
The IUPAC name of (E)-1-methoxy-2-(2-methylphenyl)ethenol (CID 135049956) is (E)-1-methoxy-2-(2-methylphenyl)ethenol.
What is the SMILES notation for (E)-1-methoxy-2-(2-methylphenyl)ethenol?
The canonical SMILES for (E)-1-methoxy-2-(2-methylphenyl)ethenol is CO/C(O)=C/c1ccccc1C.
What is the InChIKey of (E)-1-methoxy-2-(2-methylphenyl)ethenol?
The InChIKey is SIOGUZDQQUENBO-JXMROGBWSA-N. The full InChI is InChI=1S/C10H12O2/c1-8-5-3-4-6-9(8)7-10(11)12-2/h3-7,11H,1-2H3/b10-7+.
What are the key properties of (E)-1-methoxy-2-(2-methylphenyl)ethenol?
(E)-1-methoxy-2-(2-methylphenyl)ethenol has a molecular weight of 164.20 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-methoxy-2-(2-methylphenyl)ethenol is sourced from PubChem (CID 135049956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).