1-(4-hydroxyphenyl)propan-1-one

C9H10O2 — CID 6271

💊View drug profile → paroxypropione
IUPAC1-(4-hydroxyphenyl)propan-1-one
SMILESCCC(=O)c1ccc(O)cc1
InChIInChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
InChIKeyRARSHUDCJQSEFJ-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.98
Rot. Bonds2

About 1-(4-hydroxyphenyl)propan-1-one

1-(4-hydroxyphenyl)propan-1-one (PubChem CID 6271) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)propan-1-one.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)propan-1-one
PubChem CID6271
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Name1-(4-hydroxyphenyl)propan-1-one
SMILESCCC(=O)c1ccc(O)cc1
InChIInChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
InChIKeyRARSHUDCJQSEFJ-UHFFFAOYSA-N
XLogP1.98
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-hydroxyphenyl)propan-1-one 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

4-Hydroxybenzoic Acid
CID 135
Methylparaben
CID 7456
Propylparaben
CID 7175
Butylparaben
CID 7184
Ethylparaben
CID 8434
4-Hydroxybenzaldehyde
CID 126
Hydroxyphenylacetic acid
CID 127
4'-Hydroxyacetophenone
CID 7469
4-(4'-Hydroxyphenyl)-2-butanone
CID 21648
2'-Hydroxyacetophenone
CID 8375
4'-Methoxyacetophenone
CID 7476
Isoliquiritigenin
CID 638278

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)propan-1-one?
The IUPAC name of 1-(4-hydroxyphenyl)propan-1-one (CID 6271) is 1-(4-hydroxyphenyl)propan-1-one.
What is the SMILES notation for 1-(4-hydroxyphenyl)propan-1-one?
The canonical SMILES for 1-(4-hydroxyphenyl)propan-1-one is CCC(=O)c1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)propan-1-one?
The InChIKey is RARSHUDCJQSEFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3.
What are the key properties of 1-(4-hydroxyphenyl)propan-1-one?
1-(4-hydroxyphenyl)propan-1-one has a molecular weight of 150.18 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)propan-1-one is sourced from PubChem (CID 6271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).