Basic information
- Standard SMILES
O=P(O)(c1ccccc1)c1ccccc1- InChIKey
BEQVQKJCLJBTKZ-UHFFFAOYSA-N- Molecular formula
- C12H11O2P
- Average molar mass
- 218.19 g/mol
- Monoisotopic mass
- 218.04966622
Overview
Diphenylphosphinic acid is a member of phosphinic acids.
Names & identifiers
- Preferred name
- Diphenylphosphinic acid
- IUPAC
- diphenylphosphinic acid
- English name
- Diphenylphosphinic acid
- Molecular formula
- C12H11O2P
- Molecular weight
- 218.19
Names & synonyms
Show more names
Database identifiers
- CAS
1707-03-5- PubChem CID
- 15567
- DTXSID
DTXSID70168929- ChEBI
CHEBI:37832- UNII
- 3R2HB96RZT
- EC Number
- 216-948-5
- Nikkaji
- J142.921C
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 218
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 193 · 193-195 °C(lit.)
- Boiling point
- 194 °C · 194 °C
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- 0.1 M · 0.1 M NaOH: soluble0.5g/10 mL, clear, colorless
- form
- Fine Crystalline Solid
- pka
- 2.3 · 2.30±0.10(Predicted)
- color
- White
- Water Solubility
- Soluble in water.
- BRN
- 2804567 · 2804567
- InChI
- InChI=1S/C12H11O2P/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H,13,14)
- InChIKey
- BEQVQKJCLJBTKZ-UHFFFAOYSA-N
- SMILES
- P(C1=CC=CC=C1)(C1=CC=CC=C1)(O)=O
- CAS DataBase Reference
- 1707 · 1707-03-5(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 3 R2HB96RZT · 3R2HB96RZT
- NIST Chemistry Reference
- Diphenyl phosphinic acid(1707-03-5)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- RTECS
- 5315000 · SZ5315000
- HS Code
- 29310095 · 29310095
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 12.5% (1 of 8) of reports.
Warning
H315 (87.5%): 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 8 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- rtecs
- SZ5315000
- hs_code
- 29310095
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Applications
UsesDiphenylphosphinic acid is used as a reagent employed in the synthesis of bidentate ligands and peptide coupling agents.
General DescriptionDiphenylphosphinic acid (DPPA, hdpp) is an organophosphinic acid compound. It finds application as a reactive flame-retardant and promoter for palladium catalytic systems. Thermal degradation of DPPA has been studied by thermogravimetric analysis (TGA) method. DPPA reacts with cadmium nitrate in dimethylformamide solvent to afford the one-dimensional coordination polymer catena-poly[[bis(dimethylformamide-κO)cadmium(II)]-bis(μ-diphenylphosphinato-κ(2)O:O′)]. It has been repoted to promote the carbonylation of nitrobenzene and aniline to diphenylurea. Ortho-lithiated DPPA can form mono ortho-functionalized derivatives by electrophilic trapping and biphenyl-2,2′-diylbis(phenylphosphinic acid) by copper catalyzed coupling.
Upstream & downstream products
Downstream products
Suppliers50 total
Additional notes
DefinitionChEBI: Diphenylphosphinic acid is a member of phosphinic acids.
Related reactions
Linked notes
Loading…