Potassium 3,4-(methylenedioxy)phenyltrifluoroborate
Basic information
- CAS
871231-46-8- Standard SMILES
F[B-](F)(F)c1ccc2c(c1)OCO2.[K+]- InChIKey
DGKKZZSEXSGSIG-UHFFFAOYSA-N- Molecular formula
- C7H5BF3KO2
- Average molar mass
- 228.02 g/mol
- Monoisotopic mass
- 227.9971755
Names & identifiers
- Preferred name
- Potassium 3,4-(methylenedioxy)phenyltrifluoroborate
- IUPAC
- potassium 1,3-benzodioxol-5-yl(trifluoro)boranuide
- English name
- Potassium 3,4-(methylenedioxy)phenyltri&
- Molecular formula
- C7H5BF3O2.K
- Molecular weight
- 228.018
Names & synonyms
Potassium 3,4-(methylenedioxy)phenyltrifluoroborateRefChem:867577624-013-1871231-46-8Potassium benzo[d][1,3]dioxol-5-yltrifluoroborateMFCD08276799potassium (2H-1,3-benzodioxol-5-yl)trifluoroboranuidepotassium;1,3-benzodioxol-5-yl(trifluoro)boranuideSCHEMBL15920666DTXSID00635710AKOS012986520AS-2697
Show more names
potassium,1,3-benzodioxol-5-yl(trifluoro)boranuidepotassium 1，3-benzodioxol-5-yl(trifluoro)borate(1-)3,4-(methylenedioxy)phenyltrifluoroboronic acidpotasium
C76850Potassium 3Potassium 3,4-(methylenedioxy)-phenyltrifluoroborateA922950DGKKZZSEXSGSIG-UHFFFAOYSA-NSY113228EN300-1253079F516618
Database identifiers
- CAS
871231-46-8- PubChem CID
- 23697348
- DTXSID
DTXSID00635710- EC Number
- 624-013-1
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Melting point
- 236 · 236-242°C
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
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 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
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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