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| CAS No.: | 871-95-4 |
|---|---|
| Name: | APO-12 |
| Article Data: | 11 |
| Molecular Structure: | |
|
|
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| Formula: | C14H31OP |
| Molecular Weight: | 246.373 |
| Synonyms: | Dimethyldodecylphosphineoxide;Dimethyllaurylphosphine oxide;Dodecyldimethylphosphine oxide;n-Dodecyldimethylphosphine oxide; |
| EINECS: | 212-818-7 |
| Density: | 0.868 g/cm3 |
| Boiling Point: | 371.7 °C at 760 mmHg |
| Flash Point: | 178.6 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 26.88000 |
| LogP: | 5.53000 |
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Specification
The Phosphine oxide,dodecyldimethyl-, with CAS registry number 871-95-4, has the systematic name of dodecyl(dimethyl)phosphane oxide. Besides this, it is also called APO-12, Dimethyldodecylphosphine oxide. The chemical formula of this chemical is C14H31OP. What's more, its EINECS is 212-818-7.
Physical properties of Phosphine oxide,dodecyldimethyl-: (1)ACD/LogP: 4.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.08; (4)ACD/LogD (pH 7.4): 4.08; (5)ACD/BCF (pH 5.5): 748.29; (6)ACD/BCF (pH 7.4): 748.29; (7)ACD/KOC (pH 5.5): 3970.63; (8)ACD/KOC (pH 7.4): 3970.63; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 26.88 Å2; (13)Index of Refraction: 1.433; (14)Molar Refractivity: 73.78 cm3; (15)Molar Volume: 283.7 cm3; (16)Polarizability: 29.24×10-24cm3; (17)Surface Tension: 29.4 dyne/cm; (18)Density: 0.868 g/cm3; (19)Flash Point: 178.6 °C; (20)Enthalpy of Vaporization: 59.44 kJ/mol; (21)Boiling Point: 371.7 °C at 760 mmHg; (22)Vapour Pressure: 2.17E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Phosphine oxide,dodecyldimethyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=P(CCCCCCCCCCCC)(C)C
(2)InChI: InChI=1/C14H31OP/c1-4-5-6-7-8-9-10-11-12-13-14-16(2,3)15/h4-14H2,1-3H3
(3)InChIKey: SIDULKZCBGMXJL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C14H31OP/c1-4-5-6-7-8-9-10-11-12-13-14-16(2,3)15/h4-14H2,1-3H3
(5)Std. InChIKey: SIDULKZCBGMXJL-UHFFFAOYSA-N