(2-prop-2-enoxyphenyl)methanol

C10H12O2 — CID 11137475

IUPAC(2-prop-2-enoxyphenyl)methanol
SMILESC=CCOc1ccccc1CO
InChIInChI=1S/C10H12O2/c1-2-7-12-10-6-4-3-5-9(10)8-11/h2-6,11H,1,7-8H2
InChIKeyYMNIXHJCEMKHML-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.74
Rot. Bonds4

About (2-prop-2-enoxyphenyl)methanol

(2-prop-2-enoxyphenyl)methanol (PubChem CID 11137475) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is (2-prop-2-enoxyphenyl)methanol.

Molecular Properties

Compound Name(2-prop-2-enoxyphenyl)methanol
PubChem CID11137475
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name(2-prop-2-enoxyphenyl)methanol
SMILESC=CCOc1ccccc1CO
InChIInChI=1S/C10H12O2/c1-2-7-12-10-6-4-3-5-9(10)8-11/h2-6,11H,1,7-8H2
InChIKeyYMNIXHJCEMKHML-UHFFFAOYSA-N
XLogP1.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-prop-2-enoxy-2-[(2-prop-2-enoxyphenyl)methoxymethyl]benzene
CID 102306683
(2-hept-6-enoxyphenyl)methanol
CID 107007457
(4-fluoro-2-prop-2-enoxyphenyl)methanol
CID 67448374
2-[(2-prop-2-enoxyphenyl)methylamino]ethanol
CID 7937309
[2,5-bis(hydroxymethyl)-4-prop-2-enoxyphenyl]methanol
CID 101326378
N-[(2-prop-2-enoxyphenyl)methyl]ethanamine
CID 11988163
bis[(2-prop-2-enoxyphenyl)methyl] carbonate
CID 129103920
(E)-4-[2-(hydroxymethyl)phenoxy]but-2-enoic acid
CID 63653773
N-[(2-prop-2-enoxyphenyl)methyl]ethanamine;hydrochloride
CID 17123243
2-methyl-2-[(2-prop-2-enoxyphenyl)methylamino]propane-1,3-diol
CID 7935968
1,1-dimethyl-2-[(2-prop-2-enoxyphenyl)methyl]hydrazine
CID 83005876
2-methyl-N-[(2-prop-2-enoxyphenyl)methyl]propan-2-amine
CID 7937412

Frequently Asked Questions

What is the IUPAC name of (2-prop-2-enoxyphenyl)methanol?
The IUPAC name of (2-prop-2-enoxyphenyl)methanol (CID 11137475) is (2-prop-2-enoxyphenyl)methanol.
What is the SMILES notation for (2-prop-2-enoxyphenyl)methanol?
The canonical SMILES for (2-prop-2-enoxyphenyl)methanol is C=CCOc1ccccc1CO.
What is the InChIKey of (2-prop-2-enoxyphenyl)methanol?
The InChIKey is YMNIXHJCEMKHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c1-2-7-12-10-6-4-3-5-9(10)8-11/h2-6,11H,1,7-8H2.
What are the key properties of (2-prop-2-enoxyphenyl)methanol?
(2-prop-2-enoxyphenyl)methanol has a molecular weight of 164.20 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-prop-2-enoxyphenyl)methanol is sourced from PubChem (CID 11137475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).