-
Name
2-Hexylphenol
- EINECS
- CAS No. 3226-32-2
- Article Data7
- CAS DataBase
- Density 0.954g/cm3
- Solubility 40mg/L(25 oC)
- Melting Point 37.99°C (estimate)
- Formula C12H18 O
- Boiling Point 270.4°Cat760mmHg
- Molecular Weight 178.274
- Flash Point 139.9°C
- Transport Information
- Appearance
- Safety Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Phenol,o-hexyl- (6CI,7CI,8CI); 2-Hexylphenol; o-Hexylphenol
- PSA 20.23000
- LogP 3.51500
2-Hexylphenol Chemical Properties
Product Name: 2-Hexylphenol (CAS NO.3226-32-2)
Molecular Formula: C12H18O
Molecular Weight: 178.30g/mol
Mol File: 3226-32-2.mol
Boiling point: 270.4 °C at 760 mmHg
Storage Temperature:
Flash Point: 139.9 °C
Density: 0.954g/cm3
Surface Tension: 36.2 dyne/cm
Enthalpy of Vaporization: 52.9 kJ/mol
Vapour Pressure: 0.00414 mmHg at 25°C
XLogP3-AA: 4.6
H-Bond Donor: 1
H-Bond Acceptor: 1
Rotatable Bond Count: 5
Tautomer Count: 3
Topological Polar Surface Area: 20.2
Heavy Atom Count: 13
Complexity: 122
Covalently-Bonded Unit Count: 1
2-Hexylphenol Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | oral | 1300mg/kg (1300mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 53, Pg. 218, 1935. |
2-Hexylphenol Safety Profile
Moderately toxic by ingestion. When heated to decomposition it emits acrid smoke and irritating vapors.
2-Hexylphenol Standards and Recommendations
DOT Classification: 6.1; Label: KEEP AWAY FROM FOOD
2-Hexylphenol Specification
2-Hexylphenol ,its CAS NO. is 3226-32-2,the synonyms is Phenol, o-hexyl- ; o-Hexylphenol .
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