4-(1-hydroxypropyl)phenol

C9H12O2 — CID 13055557

IUPAC4-(1-hydroxypropyl)phenol
SMILESCCC(O)c1ccc(O)cc1
InChIInChI=1S/C9H12O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,9-11H,2H2,1H3
InChIKeyWEKMUBUZJDWJIR-UHFFFAOYSA-N
MW152.19 g/mol
LogP1.84
Rot. Bonds2

About 4-(1-hydroxypropyl)phenol

4-(1-hydroxypropyl)phenol (PubChem CID 13055557) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is 4-(1-hydroxypropyl)phenol.

Molecular Properties

Compound Name4-(1-hydroxypropyl)phenol
PubChem CID13055557
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name4-(1-hydroxypropyl)phenol
SMILESCCC(O)c1ccc(O)cc1
InChIInChI=1S/C9H12O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,9-11H,2H2,1H3
InChIKeyWEKMUBUZJDWJIR-UHFFFAOYSA-N
XLogP1.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(1-hydroxypropyl)phenol 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-tert-Pentylphenol
CID 6643
P-Cresol
CID 2879
Diethylstilbestrol
CID 448537
O-Cresol
CID 335
2,4-Dimethylphenol
CID 7771
Dienestrol
CID 667476
Salicyl Alcohol
CID 5146
4-tert-Butylphenol
CID 7393
Octopamine
CID 4581
Tyrosol
CID 10393
4-Nonylphenol
CID 1752
1-Phenylethanol
CID 7409

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxypropyl)phenol?
The IUPAC name of 4-(1-hydroxypropyl)phenol (CID 13055557) is 4-(1-hydroxypropyl)phenol.
What is the SMILES notation for 4-(1-hydroxypropyl)phenol?
The canonical SMILES for 4-(1-hydroxypropyl)phenol is CCC(O)c1ccc(O)cc1.
What is the InChIKey of 4-(1-hydroxypropyl)phenol?
The InChIKey is WEKMUBUZJDWJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6,9-11H,2H2,1H3.
What are the key properties of 4-(1-hydroxypropyl)phenol?
4-(1-hydroxypropyl)phenol has a molecular weight of 152.19 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxypropyl)phenol is sourced from PubChem (CID 13055557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).