Basic information
- CAS
94-83-7- Standard SMILES
O=C(OCCOc1ccc(Cl)cc1Cl)c1ccccc1- InChIKey
LGURYBCSJPXHTF-UHFFFAOYSA-N- Molecular formula
- C15H12Cl2O3
- Average molar mass
- 311.2 g/mol
- Monoisotopic mass
- 310.0163496
Names & identifiers
- Preferred name
- 2-(2,4-Dichlorophenoxy)ethyl benzoate
- IUPAC
- 2-(2,4-dichlorophenoxy)ethyl benzoate
- English name
- 2-(2,4-dichlorophenoxy)ethyl benzoate
- Molecular formula
- C15H12Cl2O3
- Molecular weight
- 311.16
Names & synonyms
2-(2,4-Dichlorophenoxy)ethyl benzoateSesin2,4-DEB2,4-Dichlorophenoxyethyl benzoateCaswell No. 317EINECS 202-367-4UNII-6H2A01VER0NSC 42928EPA Pesticide Chemical Code 030603BRN 33823176H2A01VER0Ethanol, 2-(2,4-dichlorophenoxy)-, benzoate
Show more names
1-benzoyloxy-2-(2,4-dichloro-phenoxy)-ethaneEthanol, 2-(2,4-dichlorophenoxy)-, 1-benzoate
NSC-42928SESIN [MI]DTXSID8041296Ethanol,2-(2,4-dichlorophenoxy)-, 1-benzoate4-09-00-00355 (Beilstein Handbook Reference)DICHLOROPHENOXY)ETHYL BENZOATE, 2-(2,4-RefChem:83913DTXCID6021296
Database identifiers
- CAS
94-83-7- PubChem CID
- 7208
- DTXSID
DTXSID8041296- UNII
- 6H2A01VER0
- EC Number
- 202-367-4
- Nikkaji
- J11.613K
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Melting point
- 66 ° · 66°
- Boiling point
- 1.5 · bp1.5 185°
- Density
- 1.271 · 1.2710 (rough estimate)
- refractive index
- 1.581 · 1.5810 (estimate)
- Water Solubility
- 48 mg/L · 48mg/L(temperature not stated)
- FDA UNII
- 6 H2A01VER0 · 6H2A01VER0
- EPA Substance Registry System
- 2 · 2-(2,4-Dichlorophenoxy)ethyl benzoate (94-83-7)
Chemistry & industry
Applications
UsesIn weed control.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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