Basic information
- CAS
61775-25-5- Standard SMILES
N#CC(=O)c1cccc(Oc2ccccc2)c1- InChIKey
RBJUQCDEOCYPBM-UHFFFAOYSA-N- Molecular formula
- C14H9NO2
- Average molar mass
- 223.23 g/mol
- Monoisotopic mass
- 223.06332853
Names & identifiers
- Preferred name
- Acetonitrile, (m-phenoxyphenyl)oxo-
- IUPAC
- 3-phenoxybenzoyl cyanide
- English name
- (m-Phenoxyphenyl)oxoacetonitrile
- Molecular formula
- C14H9NO2
- Molecular weight
- 223.23
Names & synonyms
3-Phenoxybenzoyl cyanide61775-25-5(m-Phenoxyphenyl)oxoacetonitrilem-Phenoxybenzoyl cyanideACETONITRILE, (m-PHENOXYPHENYL)OXO-alpha-Oxo-3-phenoxybenzeneacetonitrileBRN 2114224Benzeneacetonitrile, alpha-oxo-3-phenoxy-DTXSID70210770RefChem:316841DTXCID00133261SCHEMBL9162725
Show more names
RBJUQCDEOCYPBM-UHFFFAOYSA-NBenzeneacetonitrile, α-oxo-3-phenoxy-
3-Phenoxybenzene-1-carbonyl cyanideDB-290122
Database identifiers
- CAS
61775-25-5- PubChem CID
- 43787
- DTXSID
DTXSID70210770- Nikkaji
- J90.704I
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 50.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 311
Physicochemical properties
- Boiling point
- 352.5 · 352.5±25.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
Chemistry & industry
Applications
Uses3-Phenoxybenzoyl Cyanide, is used in the synthesis of the potent pyrethroid insecticide α-Cyano-3-phenoxybenzyl cis-2,2-dimethyl-3-(2,2-dibromovinyl)cyclopropanecarboxylate.
Uses3-Phenoxybenzoyl Cyanide, is used in the synthesis of the potent pyrethroid insecticide α-Cyano-3-phenoxybenzyl cis-2,2-dimethyl-3-(2,2-dibromovinyl)cyclopropanecarboxylate.
Suppliers4 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…