-
Name
2-Propoxyphenol
- EINECS 228-484-0
- CAS No. 6280-96-2
- Article Data17
- CAS DataBase
- Density 1.05 g/cm3
- Solubility 2.359g/L(24.99 oC)
- Melting Point
- Formula C9H12O2
- Boiling Point 228.5 °C at 760 mmHg
- Molecular Weight 152.193
- Flash Point 97.2 °C
- Transport Information
- Appearance white to beige crystal
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Phenol,o-propoxy- (7CI,8CI);2-Propoxyphenol;Catechol monopropyl ether;NSC 6186;o-(n-Propyloxy)phenol;o-Propoxyphenol;
- PSA 29.46000
- LogP 2.18100
2-Propoxyphenol Specification
The 2-Propoxyphenol with the cas number 6280-96-2 is also called Phenol, 2-propoxy-. Its EINECS registry number is 228-484-0. The molecular formula is C9H12O2. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 2.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/LogD (pH 7.4): 2.25; (5)ACD/BCF (pH 5.5): 30.17; (6)ACD/BCF (pH 7.4): 30.03; (7)ACD/KOC (pH 5.5): 398.71; (8)ACD/KOC (pH 7.4): 396.84; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.52; (14)Molar Refractivity: 44.07 cm3; (15)Molar Volume: 144.8 cm3; (16)Polarizability: 17.47 ×10-24cm3; (17)Surface Tension: 37.5 dyne/cm; (18)Enthalpy of Vaporization: 48.4 kJ/mol; (19)Vapour Pressure: 0.0486 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccccc1O)CCC
(2)InChI: InChI=1/C9H12O2/c1-2-7-11-9-6-4-3-5-8(9)10/h3-6,10H,2,7H2,1H3
(3)InChIKey: JFSVGKRARHIICJ-UHFFFAOYAS
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