1-(2,4-dihydroxyphenyl)-2-hydroxyethanone

C8H8O4 — CID 11715230

IUPAC1-(2,4-dihydroxyphenyl)-2-hydroxyethanone
SMILESO=C(CO)c1ccc(O)cc1O
InChIInChI=1S/C8H8O4/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,9-11H,4H2
InChIKeyDYKBONVDLJHZLM-UHFFFAOYSA-N
MW168.15 g/mol
LogP0.27
Rot. Bonds2

About 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone

1-(2,4-dihydroxyphenyl)-2-hydroxyethanone (PubChem CID 11715230) has the molecular formula C8H8O4 and a molecular weight of 168.15 g/mol. Its IUPAC name is 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone.

Molecular Properties

Compound Name1-(2,4-dihydroxyphenyl)-2-hydroxyethanone
PubChem CID11715230
Molecular FormulaC8H8O4
Molecular Weight168.15 g/mol
Exact Mass168.04
IUPAC Name1-(2,4-dihydroxyphenyl)-2-hydroxyethanone
SMILESO=C(CO)c1ccc(O)cc1O
InChIInChI=1S/C8H8O4/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,9-11H,4H2
InChIKeyDYKBONVDLJHZLM-UHFFFAOYSA-N
XLogP0.27
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.15
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,4-dihydroxyphenyl)-3-hydroxypropan-1-one
CID 130033868
azane;1-(2,4-dihydroxyphenyl)-2-hydroxyethanone;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 90353711
2-hydroxy-1-(2-hydroxy-4-methylphenyl)ethanone
CID 68538226
2,4-dihydroxybenzoic acid
CID 1491
1-(2-chlorophenyl)-3-(2,4-dihydroxyphenyl)propane-1,3-dione
CID 52916523
3-(diethylamino)-1-(2,4-dihydroxyphenyl)propan-1-one
CID 121004187
1-(2,4-dihydroxyphenyl)-2-(2-methylpropylsulfanyl)ethanone
CID 43232339
(3E)-1-(2,4-dihydroxyphenyl)-3-methylhexa-3,5-dien-1-one
CID 143932136
1-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]piperidin-4-one
CID 60650473
1-(2,4-dihydroxyphenyl)-2-(4-ethoxyphenoxy)ethanone
CID 678669
2-[butyl(methyl)amino]-1-(2,4-dihydroxyphenyl)ethanone
CID 43219653
2-[3-hydroxy-4-(2-hydroxyacetyl)phenoxy]ethanesulfonic acid
CID 56989048

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone?
The IUPAC name of 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone (CID 11715230) is 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone.
What is the SMILES notation for 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone?
The canonical SMILES for 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone is O=C(CO)c1ccc(O)cc1O.
What is the InChIKey of 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone?
The InChIKey is DYKBONVDLJHZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O4/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,9-11H,4H2.
What are the key properties of 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone?
1-(2,4-dihydroxyphenyl)-2-hydroxyethanone has a molecular weight of 168.15 g/mol, XLogP of 0.27, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dihydroxyphenyl)-2-hydroxyethanone is sourced from PubChem (CID 11715230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).