2'-Hydroxyacetophenone

C8H8O2 — CID 8375

IUPAC1-(2-hydroxyphenyl)ethanone
SMILESCC(=O)C1=CC=CC=C1O
InChIInChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3
InChIKeyJECYUBVRTQDVAT-UHFFFAOYSA-N
MW136.15 g/mol
LogP1.90
Rot. Bonds1

About 2'-Hydroxyacetophenone

2'-Hydroxyacetophenone (PubChem CID 8375) has the molecular formula C8H8O2 and a molecular weight of 136.15 g/mol. Its IUPAC name is 1-(2-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2'-Hydroxyacetophenone
PubChem CID8375
Molecular FormulaC8H8O2
Molecular Weight136.15 g/mol
Exact Mass136.05
IUPAC Name1-(2-hydroxyphenyl)ethanone
SMILESCC(=O)C1=CC=CC=C1O
InChIInChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3
InChIKeyJECYUBVRTQDVAT-UHFFFAOYSA-N
XLogP1.90
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity131

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Salicylic Acid
CID 338
Methyl Salicylate
CID 4133
(2-Hydroxyphenyl)acetic acid
CID 11970
Salicylaldehyde
CID 6998
Plumbagin
CID 10205
Sodium Salicylate
CID 16760658
4'-Hydroxyacetophenone
CID 7469
Juglone
CID 3806
2,2',4,4'-Tetrahydroxybenzophenone
CID 8571
4-(4'-Hydroxyphenyl)-2-butanone
CID 21648
3-Methylsalicylic Acid
CID 6738
2-Ethylhexyl salicylate
CID 8364

Frequently Asked Questions

What is the IUPAC name of 2'-Hydroxyacetophenone?
The IUPAC name of 2'-Hydroxyacetophenone (CID 8375) is 1-(2-hydroxyphenyl)ethanone.
What is the SMILES notation for 2'-Hydroxyacetophenone?
The canonical SMILES for 2'-Hydroxyacetophenone is CC(=O)C1=CC=CC=C1O.
What is the InChIKey of 2'-Hydroxyacetophenone?
The InChIKey is JECYUBVRTQDVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3.
What are the key properties of 2'-Hydroxyacetophenone?
2'-Hydroxyacetophenone has a molecular weight of 136.15 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-Hydroxyacetophenone is sourced from PubChem (CID 8375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).