1-(4-hydroxyphenyl)(211C)ethanone

C8H8O2 — CID 177408736

IUPAC1-(4-hydroxyphenyl)(211C)ethanone
SMILES[11CH3]C(=O)c1ccc(O)cc1
InChIInChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3/i1-1
InChIKeyTXFPEBPIARQUIG-BJUDXGSMSA-N
MW135.15 g/mol
LogP1.59
Rot. Bonds1

About 1-(4-hydroxyphenyl)(211C)ethanone

1-(4-hydroxyphenyl)(211C)ethanone (PubChem CID 177408736) has the molecular formula C8H8O2 and a molecular weight of 135.15 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)(211C)ethanone.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)(211C)ethanone
PubChem CID177408736
Molecular FormulaC8H8O2
Molecular Weight135.15 g/mol
Exact Mass135.06
IUPAC Name1-(4-hydroxyphenyl)(211C)ethanone
SMILES[11CH3]C(=O)c1ccc(O)cc1
InChIInChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3/i1-1
InChIKeyTXFPEBPIARQUIG-BJUDXGSMSA-N
XLogP1.59
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.15
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-hydroxyphenyl)ethanone;phosphane
CID 145192657
butane;1-(4-hydroxyphenyl)ethanone
CID 142352310
1-(4-acetylphenyl)ethanone;methane
CID 159515104
1-(4-hydroxyphenyl)ethanone;propane-1,2,3-triol
CID 174948950
1-(4-hydroxyphenyl)ethanone;4-(1-methylcyclopropyl)phenol
CID 161486309
1-[3-acetyl-5-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]ethanone;1-[4-[(E)-2-(3,5-diacetylphenyl)ethenyl]phenyl]ethanone
CID 68724817
1-(4-hydroxyphenyl)ethanone;4-pentylphenol
CID 70426923
4-acetyl(11C)benzoic acid
CID 11205952
1-(4-arsanylphenyl)ethanone
CID 173138956
1-(4-methylphenyl)ethanone;hydrochloride
CID 172692328
acetamide;4-hydroxybenzoic acid
CID 67150268
1-(2-hydroxyphenyl)ethanone;1-(3-hydroxyphenyl)ethanone;1-(4-hydroxyphenyl)ethanone
CID 158730287

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)(211C)ethanone?
The IUPAC name of 1-(4-hydroxyphenyl)(211C)ethanone (CID 177408736) is 1-(4-hydroxyphenyl)(211C)ethanone.
What is the SMILES notation for 1-(4-hydroxyphenyl)(211C)ethanone?
The canonical SMILES for 1-(4-hydroxyphenyl)(211C)ethanone is [11CH3]C(=O)c1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)(211C)ethanone?
The InChIKey is TXFPEBPIARQUIG-BJUDXGSMSA-N. The full InChI is InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3/i1-1.
What are the key properties of 1-(4-hydroxyphenyl)(211C)ethanone?
1-(4-hydroxyphenyl)(211C)ethanone has a molecular weight of 135.15 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)(211C)ethanone is sourced from PubChem (CID 177408736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).