2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone

C11H12O3 — CID 19910773

IUPAC2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone
SMILESC=CCOc1ccccc1C(=O)CO
InChIInChI=1S/C11H12O3/c1-2-7-14-11-6-4-3-5-9(11)10(13)8-12/h2-6,12H,1,7-8H2
InChIKeyUKTHKQDRNDHNQL-UHFFFAOYSA-N
MW192.21 g/mol
LogP1.43
Rot. Bonds5

About 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone

2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone (PubChem CID 19910773) has the molecular formula C11H12O3 and a molecular weight of 192.21 g/mol. Its IUPAC name is 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone.

Molecular Properties

Compound Name2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone
PubChem CID19910773
Molecular FormulaC11H12O3
Molecular Weight192.21 g/mol
Exact Mass192.08
IUPAC Name2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone
SMILESC=CCOc1ccccc1C(=O)CO
InChIInChI=1S/C11H12O3/c1-2-7-14-11-6-4-3-5-9(11)10(13)8-12/h2-6,12H,1,7-8H2
InChIKeyUKTHKQDRNDHNQL-UHFFFAOYSA-N
XLogP1.43
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-1-(2-prop-2-enoxyphenyl)ethanone
CID 12579607
bis(2-prop-2-enoxyphenyl)methanone
CID 54013636
2-prop-2-enoxybenzenecarboperoxoic acid
CID 88627610
2-prop-2-enoxybenzoic acid;hydrochloride
CID 70025071
CID 70191473
CID 70191473
2-[2-(2-hydroxyacetyl)phenoxy]acetic acid
CID 23600039
1-(4-hydroxyphenyl)-5-(2-prop-2-enoxyphenyl)pentane-1,3,5-trione
CID 10806921
N-methoxy-N-methyl-2-prop-2-enoxybenzamide
CID 60735297
N-(4-hydroxybutan-2-yl)-2-prop-2-enoxybenzamide
CID 113278524
N'-(2-iodobenzoyl)-2-prop-2-enoxybenzohydrazide
CID 4929047
methyl 2-(2-prop-2-enoxybenzoyl)prop-2-enoate
CID 10083253
[2-(2-hydroxyacetyl)phenyl] acetate
CID 101117820

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone?
The IUPAC name of 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone (CID 19910773) is 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone.
What is the SMILES notation for 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone?
The canonical SMILES for 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone is C=CCOc1ccccc1C(=O)CO.
What is the InChIKey of 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone?
The InChIKey is UKTHKQDRNDHNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O3/c1-2-7-14-11-6-4-3-5-9(11)10(13)8-12/h2-6,12H,1,7-8H2.
What are the key properties of 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone?
2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone has a molecular weight of 192.21 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-(2-prop-2-enoxyphenyl)ethanone is sourced from PubChem (CID 19910773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).