Urea,N,N'-bis(2,3,4,5,6-pentafluorophenyl)- supplier

Name
N,N'-BIS(PENTAFLUOROPHENYL)UREA
EINECS 244-231-7
CAS No. 21132-30-9
Article Data4
CAS DataBase
Density 1.85 g/cm³
Solubility
Melting Point 269-270 °C
Formula C₁₃H₂F₁₀N₂O
Boiling Point 200.8 °C at 760 mmHg
Molecular Weight 392.156
Flash Point 75.2 °C
Transport Information
Appearance
Safety 22-24/25
Risk Codes 22-24/25
Molecular Structure
Hazard Symbols Xi
Synonyms Urea, N,N'-bis(pentafluorophenyl)-;
PSA 41.13000
LogP 4.86760

Urea,N,N'-bis(2,3,4,5,6-pentafluorophenyl)- Specification

The Urea,N,N'-bis(2,3,4,5,6-pentafluorophenyl)-, with the CAS registry number of 21132-30-9, is also known as Urea, N,N'-bis(pentafluorophenyl)-. Its EINECS registry number is 244-231-7. Its molecular formula is C₁₃H₂F₁₀N₂O and molecular weight is 392.15. What's more, its IUPAC name is 1,3-Bis(2,3,4,5,6-pentafluorophenyl)urea. The dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.

Physical properties about the Urea,N,N'-bis(2,3,4,5,6-pentafluorophenyl)- are: (1)ACD/LogP: 5.41; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.39; (4)ACD/LogD (pH 7.4): 4.71; (5)ACD/BCF (pH 5.5): 7236.21; (6)ACD/BCF (pH 7.4): 1513.4; (7)ACD/KOC (pH 5.5): 19854.75; (8)ACD/KOC (pH 7.4): 4152.46; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 23.55 Å²; (13)Index of Refraction: 1.525; (14)Molar Refractivity: 65.01 cm³; (15)Molar Volume: 211.9 cm³; (16)Surface Tension: 41.1 dyne/cm; (17)Density: 1.85 g/cm³; (18)Flash Point: 75.2 °C; (19)Enthalpy of Vaporization: 43.7 kJ/mol; (20)Boiling Point: 200.8 °C at 760 mmHg; (21)Vapour Pressure: 0.319 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1c(F)c(F)c(F)c(F)c1F)Nc2c(F)c(F)c(F)c(F)c2F
(2) InChI: InChI=1/C13H2F10N2O/c14-1-3(16)7(20)11(8(21)4(1)17)24-13(26)25-12-9(22)5(18)2(15)6(19)10(12)23/h(H2,24,25,26)
(3) InChIKey: JXOIMJFRROBTTE-UHFFFAOYAM

Product Name

N,N'-BIS(PENTAFLUOROPHENYL)UREA

Urea,N,N'-bis(2,3,4,5,6-pentafluorophenyl)- Specification

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