(4-ethenoxyphenyl)methanol

C9H10O2 — CID 11159400

IUPAC(4-ethenoxyphenyl)methanol
SMILESC=COc1ccc(CO)cc1
InChIInChI=1S/C9H10O2/c1-2-11-9-5-3-8(7-10)4-6-9/h2-6,10H,1,7H2
InChIKeyHUFNLDSKVVIJMC-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.70
Rot. Bonds3

About (4-ethenoxyphenyl)methanol

(4-ethenoxyphenyl)methanol (PubChem CID 11159400) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is (4-ethenoxyphenyl)methanol.

Molecular Properties

Compound Name(4-ethenoxyphenyl)methanol
PubChem CID11159400
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Name(4-ethenoxyphenyl)methanol
SMILESC=COc1ccc(CO)cc1
InChIInChI=1S/C9H10O2/c1-2-11-9-5-3-8(7-10)4-6-9/h2-6,10H,1,7H2
InChIKeyHUFNLDSKVVIJMC-UHFFFAOYSA-N
XLogP1.70
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.70
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 (4-ethenoxyphenyl)methanol?
The IUPAC name of (4-ethenoxyphenyl)methanol (CID 11159400) is (4-ethenoxyphenyl)methanol.
What is the SMILES notation for (4-ethenoxyphenyl)methanol?
The canonical SMILES for (4-ethenoxyphenyl)methanol is C=COc1ccc(CO)cc1.
What is the InChIKey of (4-ethenoxyphenyl)methanol?
The InChIKey is HUFNLDSKVVIJMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2/c1-2-11-9-5-3-8(7-10)4-6-9/h2-6,10H,1,7H2.
What are the key properties of (4-ethenoxyphenyl)methanol?
(4-ethenoxyphenyl)methanol has a molecular weight of 150.18 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethenoxyphenyl)methanol is sourced from PubChem (CID 11159400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).