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| CAS No.: | 18872-49-6 |
|---|---|
| Name: | phosphoric acid,2-naphthalenyl diphenyl ester |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C22H17O4P |
| Molecular Weight: | 376.348 |
| Synonyms: | Phosphoricacid, 2-naphthyl diphenyl ester (8CI);(2-Naphthyl)diphenylphosphate;NDPP;NDPP (flame retardant); |
| Density: | 1.289 g/cm3 |
| Boiling Point: | 469.299 °C at 760 mmHg |
| Flash Point: | 250.856 °C |
| PSA: | 54.57000 |
| LogP: | 6.48470 |
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Specification
The 2-Naphthyl diphenyl phosphate, with the CAS registry number 18872-49-6, is also known as (2-Naphthyl)diphenylphosphate. This chemical's molecular formula is C22H17O4P and molecular weight is 376.34. What's more, its systematic name is 2-Naphthyl diphenyl phosphate.
Physical properties of 2-Naphthyl diphenyl phosphate are: (1)ACD/LogP: 5.328; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.33; (4)ACD/LogD (pH 7.4): 5.33; (5)ACD/BCF (pH 5.5): 6592.30; (6)ACD/BCF (pH 7.4): 6592.30; (7)ACD/KOC (pH 5.5): 18847.69; (8)ACD/KOC (pH 7.4): 18847.69; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 54.57 Å2; (13)Index of Refraction: 1.642; (14)Molar Refractivity: 105.514 cm3; (15)Molar Volume: 291.979 cm3; (16)Polarizability: 41.829×10-24cm3; (17)Surface Tension: 52.0 dyne/cm; (18)Density: 1.289 g/cm3; (19)Flash Point: 250.856 °C; (20)Enthalpy of Vaporization: 70.366 kJ/mol; (21)Boiling Point: 469.299 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=P(Oc1cc2ccccc2cc1)(Oc3ccccc3)Oc4ccccc4
(2)Std. InChI: InChI=1S/C22H17O4P/c23-27(24-20-11-3-1-4-12-20,25-21-13-5-2-6-14-21)26-22-16-15-18-9-7-8-10-19(18)17-22/h1-17H
(3)Std. InChIKey: JSJUBNHZCFKUKY-UHFFFAOYSA-N