(1,2-Phenylenebis(methylene))bis(triphenylphosphonium) dibromide
Basic information
- CAS
1519-46-6- Standard SMILES
c1ccc([P+](Cc2ccccc2C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)(c2ccccc2)c2ccccc2)cc1- InChIKey
NREIUFSWLHXDSG-UHFFFAOYSA-N- Molecular formula
- C44H38P2+2
- Average molar mass
- 628.7 g/mol
- Monoisotopic mass
- 628.24487521
Names & identifiers
- Preferred name
- (1,2-Phenylenebis(methylene))bis(triphenylphosphonium) dibromide
- IUPAC
- triphenyl-[[2-(triphenylphosphaniumylmethyl)phenyl]methyl]phosphanium
- English name
- 1,2-Bis(methyltriphenylphosphonium)phenyl dichloride
- Molecular formula
- C44H38P2+2
- Molecular weight
- 628.73
Names & synonyms
EINECS 216-183-7NSC 78589NSC 665614(1,2-Phenylenebis(methylene))bis(triphenylphosphonium) dibromide[1,2-phenylenebis(methylene)]bis[triphenylphosphonium] dibromideRefChem:391294216-183-7(1,2-Phenylenebis(methylene))bis(triphenylphosphonium)NCIMech_000878SCHEMBL4117115CHEMBL2009455DTXSID601366299
Show more names
o-Xylen-bis(triphenylphosphonium)1,2-Bis(methyltriphenylphosphonium)phenyl dichloride
NCI60_0226341,1a(2)-[1,2-Phenylenebis(methylene)]bis[1,1,1-triphenylphosphonium]
Database identifiers
- CAS
1519-46-6、47861-42-7- PubChem CID
- 380171
- DTXSID
DTXSID601366299- ChEMBL
CHEMBL2009455- EC Number
- 216-183-7
- Nikkaji
- J1.119.561J
Properties
Computed structural properties
- XLogP
- 10.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 10
- Heavy atoms
- 46
- Formal charge
- 2
- Complexity
- 697
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
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 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…