Name
4-propylphenol
CAS
645-56-7
HMDB ID
Synonyms
1-(4-Hydroxyphenyl)propane
1-Hydroxy-4-N-propylbenzene
1-Hydroxy-4-propylbenzene
4-N-Propylphenol
4-Propyl-Phenol
4-Propylphenol, potassium
Dihydrochavicol
FEMA 3649
P-Hydroxypropylbenzene
P-N-Propylphenol
P-Propylphenol
Phenol, p-propyl-,
p-Hydroxypropylbenzene
p-Propyl-Phenol
Molecular formula
C9H12O
Average molecular weight
136.19
Monoisotopic mass of parent ion
136.0888
Verified Purity
>99.99
Solubility
N/A
Spectra
Chromatogram
Find the volume
mg
g/mol
mM
Find the weight
mM
g/mol
mL
Find the concentration
g/mol
mL
mg
(%)
Chloroform
100
80
60
40
20
0
0
20
40
60
80
100
MeOH
(%)
(%)
H2O
100
80
60
40
20
0
0
20
40
60
80
100
MeOH
(%)
(%)
H2O
100
80
60
40
20
0
0
20
40
60
80
100
DMSO
(%)
H2O (pH)
9
8
7
6
5
4
3
Information
Version
5.0
Status
Predicted
HMDB Name
4-Propylphenol
Structure
SMILES
CCCC1=CC=C(O)C=C1
Description
4-Propylphenol is a flavouring ingredien
Physical Properties
State
Solid
Experimental Properties
Property
Value
Reference
Melting Point
21 - 22 °C
Boiling Point
232.00 to 233.00 °C. @ 760.00 mm Hg
The Good Scents Company Information System
Water Solubility
1.28 mg/mL at 25 °C
LogP
3.20
Biological Properties
Cellular Locations
Membrane
Biospecimen Locations
N/A
Tissue Locations
N/A
Normal Concentrations
Biospecimen
Status
Value
Age
Sex
Condition
Reference
Details
None available
Abnormal Concentrations
Biospecimen
Status
Value
Age
Sex
Condition
Reference
Details
None available
Spectra
Type
Description
View
Predicted GC-MS
splash10-0a4i-3900000000-8ba5a6371b85b0a13009
Predicted GC-MS
splash10-05di-5900000000-c9a0d578ebacd321bdd0
Predicted GC-MS
Predicted LC-MS/MS
splash10-000i-0900000000-6897af31a55c6b6c489a
Predicted LC-MS/MS
splash10-000i-4900000000-43041e9d28106a219141
Predicted LC-MS/MS
splash10-00kf-9200000000-08fc8dee797b19a7e4c3
Predicted LC-MS/MS
splash10-000i-0900000000-7f68ba72b07d358127ab
Predicted LC-MS/MS
splash10-000i-0900000000-d5b3c2a3b85333fb73a1
Predicted LC-MS/MS
splash10-05n3-6900000000-effca18f66999dc6aafb
Predicted LC-MS/MS
splash10-000i-0900000000-3d153ee27562ca42735c
Predicted LC-MS/MS
splash10-000i-0900000000-963f4cd125a2be6c9129
Predicted LC-MS/MS
splash10-00kf-9200000000-429794511232ff1424e2
Predicted LC-MS/MS
splash10-000i-1900000000-8d544965713f5b8a7e30
Predicted LC-MS/MS
splash10-0a6r-9500000000-538bda137edf1f506dcb
Predicted LC-MS/MS
splash10-00ou-9000000000-7c6f27a6e2e51f5030b7
Pathways
Name
SMPDB / Pathwhiz
KEGG
None available