4-(1-hydroxyhex-3-enyl)phenol

C12H16O2 — CID 175548143

IUPAC4-(1-hydroxyhex-3-enyl)phenol
SMILESCCC=CCC(O)c1ccc(O)cc1
InChIInChI=1S/C12H16O2/c1-2-3-4-5-12(14)10-6-8-11(13)9-7-10/h3-4,6-9,12-14H,2,5H2,1H3
InChIKeyWHRMTDUVTAZUQX-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.78
Rot. Bonds4

About 4-(1-hydroxyhex-3-enyl)phenol

4-(1-hydroxyhex-3-enyl)phenol (PubChem CID 175548143) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 4-(1-hydroxyhex-3-enyl)phenol.

Molecular Properties

Compound Name4-(1-hydroxyhex-3-enyl)phenol
PubChem CID175548143
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name4-(1-hydroxyhex-3-enyl)phenol
SMILESCCC=CCC(O)c1ccc(O)cc1
InChIInChI=1S/C12H16O2/c1-2-3-4-5-12(14)10-6-8-11(13)9-7-10/h3-4,6-9,12-14H,2,5H2,1H3
InChIKeyWHRMTDUVTAZUQX-UHFFFAOYSA-N
XLogP2.78
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-(1-hydroxyhex-3-enyl)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-(1-hydroxytridecyl)phenol
CID 57120972
2-[(E)-but-1-enyl]benzene-1,4-diol
CID 19910488
(Z,1S,6R)-1-phenylhept-3-ene-1,6-diol
CID 135057186
4-[(1S)-2-chloro-1-hydroxyethyl]phenol
CID 93341607
(1S)-1-(4-chlorophenyl)pent-3-en-1-ol
CID 68919875
(Z)-1-(4-bromophenyl)-5-methylhex-3-en-1-ol
CID 122392628
4-[(1S)-1-hydroxy-2-(propan-2-ylamino)ethyl]phenol
CID 76959355
(1R)-1-(4-hydroxyphenyl)butane-1,4-diol
CID 23836266
4-[(1R)-2-(butylamino)-1-hydroxyethyl]phenol
CID 2057150
butyl-[(2R)-2-hydroxy-2-(4-hydroxyphenyl)ethyl]azanium
CID 2057149
(E)-1-(4-iodophenyl)-4-methylsulfanylbut-3-en-1-ol
CID 5368136
(Z)-4-ethoxy-1-phenylbut-3-en-1-ol
CID 44889759

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxyhex-3-enyl)phenol?
The IUPAC name of 4-(1-hydroxyhex-3-enyl)phenol (CID 175548143) is 4-(1-hydroxyhex-3-enyl)phenol.
What is the SMILES notation for 4-(1-hydroxyhex-3-enyl)phenol?
The canonical SMILES for 4-(1-hydroxyhex-3-enyl)phenol is CCC=CCC(O)c1ccc(O)cc1.
What is the InChIKey of 4-(1-hydroxyhex-3-enyl)phenol?
The InChIKey is WHRMTDUVTAZUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-2-3-4-5-12(14)10-6-8-11(13)9-7-10/h3-4,6-9,12-14H,2,5H2,1H3.
What are the key properties of 4-(1-hydroxyhex-3-enyl)phenol?
4-(1-hydroxyhex-3-enyl)phenol has a molecular weight of 192.26 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxyhex-3-enyl)phenol is sourced from PubChem (CID 175548143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).