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1,6-Hexanediylbis(triphenylphosphonium)

HCID 3036660
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Basic information

CAS
22884-32-8
Standard SMILES
[Br-].[Br-].c1ccc([P+](CCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIKey
WVGJVRSXHXAHCN-UHFFFAOYSA-L
Molecular formula
C42H42Br2P2
Average molar mass
768.5 g/mol
Monoisotopic mass
766.11285

Overview

structure given in first source; RN given refers to dibromide

Names & identifiers

Preferred name
1,6-Hexanediylbis(triphenylphosphonium)
IUPAC
triphenyl(6-triphenylphosphaniumylhexyl)phosphanium dibromide
English name
1,6-Hexamethylenebis(triphenylphosphonium bromide)
Molecular formula
C42H42Br2P2
Molecular weight
768.54

Names & synonyms

HDTPP22884-32-81,6-Hexanediylbis(triphenylphosphonium)RefChem:73636Hexane-1,6-diylbis(triphenylphosphonium) bromideNSC 84072SCHEMBL52420CHEMBL354778AKOS024427454Phosphonium, 1,6-hexanediylbis(triphenyl-, dibromideAIDS-159965hexane-1,6-diylbis(triphenylphosphonium)
Show more names
1,6-Hexamethylenebis(triphenylphosphonium bromide)

Database identifiers

CAS
22884-32-8
PubChem CID
3036660
ChEMBL
CHEMBL354778
EC Number
636-594-9

Properties

Computed structural properties

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
13
Heavy atoms
46
Formal charge
0
Complexity
612

Physicochemical properties

Melting point
312 · 312-313 °C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H315-H335
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319-H315-H335
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

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Compound notes

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