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Pentafluoro(phenoxy)cyclotriphosphazene

Catalog Number
ACM33027688
CAS Number
33027-68-8
Product Name
Pentafluoro(phenoxy)cyclotriphosphazene
Structure
Category
Battery Materials; Electronic Materials
Synonyms
1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6-pentafluoro-2,2,4,4,6,6-hexahydro-6-phenoxy-
IUPAC Name
2,2,4,4,6-pentafluoro-6-phenoxy-1,3,5-triaza-2ж╦5,4ж╦5,6ж╦5-triphosphacyclohexa-1,3,5-triene
Molecular Weight
323.04
Molecular Formula
C6H5F5N3OP3
Canonical SMILES
C1=CC=C(C=C1)OP2(=NP(=NP(=N2)(F)F)(F)F)F
InChI
InChI=1S/C6H5F5N3OP3/c7-16(8)12-17(9,10)14-18(11,13-16)15-6-4-2-1-3-5-6/h1-5H
InChI Key
XNZZEQCBAGUFMT-UHFFFAOYSA-N
Boiling Point
46°C/0.8mmHg(lit.)
Purity
>98.0%(GC)
Density
1.91±0.1 g/cm³(Predicted)
Appearance
liquid
Storage
stored at 0-10°C
Complexity
459
Covalently-Bonded Unit Count
1
Exact Mass
322.956564g/mol
Formal Charge
0
Hazard Statements
H314 : Causes severe skin burns and eye damage.H411 : Toxic to aquatic life with long lasting effects.
Heavy Atom Count
18
Monoisotopic Mass
322.956564g/mol
Packaging
1g; 5g
pH
pKa: -24.59±0.39(Predicted)
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P391 : Collect spillage.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P301 + P330 + P331 : IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.P363 : Wash contaminated clothing before reuse.P304 + P340 + P310 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Immediately call a POISON CENTER/doctor.P305 + P351 + P338 + P310 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Immediately call a POISON CENTER/doctor.P405 : Store locked up.
Refractive Index
1.4300 to 1.4340
Rotatable Bond Count
2
Signal Word
Danger
Specific Gravity
1.55
XLogP3
5.1
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