Bromfenvinphos-methyl
Basic information
- CAS
13104-21-7- Standard SMILES
COP(=O)(OC)OC(=CBr)c1ccc(Cl)cc1Cl- InChIKey
LOOAGTDYKNUDBZ-UHFFFAOYSA-N- Molecular formula
- C10H10BrCl2O4P
- Average molar mass
- 375.96 g/mol
- Monoisotopic mass
- 373.88771
Names & identifiers
- Preferred name
- Bromfenvinphos-methyl
- IUPAC
- [2-bromo-1-(2,4-dichlorophenyl)ethenyl] dimethyl phosphate
- English name
- Bromfenvinphos-methyl
- Molecular formula
- C10H10BrCl2O4P
- Molecular weight
- 375.97
Names & synonyms
Bromfenvinphos-methyl13104-21-7[2-bromo-1-(2,4-dichlorophenyl)ethenyl] dimethyl phosphateIPO-63DTXSID3074494MSK20161NS000964242-Bromo-1-(2,4-dichlorophenyl)ethen-1-yl dimethyl phosphateipo63polfossd8988polphos
Show more names
ent27,043shellsd-8988sd8988(shell)METHYLBROMPHENVINFOSbromfenvinfos-methylmethylbromfenvinphos
Database identifiers
- CAS
13104-21-7- PubChem CID
- 25704
- DTXSID
DTXSID3074494- EC Number
- 635-040-3
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 345
Physicochemical properties
- Melting point
- 65.5 · 65.5-67 °C(Solv: hexane (110-54-3); carbon tetrachloride (56-23-5))
- Boiling point
- 210.6 °C · 210.6°C
- Density
- 1.63 · 1.630±0.06 g/cm3(Predicted)
- storage temp.
- 4 °C · APPROX 4°C
- BRN
- 6066591 · 6066591
- Major Application
- agricultureenvironmental
- InChI
- 1S/C10H10BrCl2O4P/c1-15-18(14,16-2)17-10(6-11)8-4-3-7(12)5-9(8)13/h3-6H,1-2H3/b10-6+
- InChIKey
- LOOAGTDYKNUDBZ-UXBLZVDNSA-N
- SMILES
- COP(=O)(OC)O\C(=C\Br)c1ccc(Cl)cc1Cl
- FDA UNII
- 935 K0CS3JR · 935K0CS3JR
- EPA Substance Registry System
- 2 · Phosphoric acid, 2-bromo-1-(2,4-dichlorophenyl)ethenyl dimethyl ester (13104-21-7)
- UNSPSC Code
- 41116107 · 41116107
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 301 · P301+P310+P330
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- Safety Statements
- 36 · 36
- RIDADR
- 2811 · UN2811 6.1/PG 3
- WGK Germany
- 3 · 3
- RTECS
- 8460000 · TB8460000
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 Oral · Acute Tox. 3 Oral
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Faceshields, Gloves
- wgk
- 3
- rtecs
- TB8460000
- ridadr
- UN2811 6.1/PG 3
- risk_code
- 22
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- Xn
- safety_code
- 36
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301
- Hazard Classifications
- Acute Tox. 3 Oral
- Precautionary statements
- P301+P310+P330
Chemistry & industry
Applications
UsesBromfenvinphos-methyl is a useful analytical reagent in the study of effective methods for pesticidde residues determination in tobacco by GC/MS and UHPLC- MS/MS while employing acetonitrile extraction with low-temperature precipitation and d-SPE clean-up
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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