2-(2,3-Dichlorophenyl)-2-hydroxyacetonitrile
Basic information
- CAS
93842-97-8- Standard SMILES
N#CC(O)c1cccc(Cl)c1Cl- InChIKey
VMBJRKFGAMINPT-UHFFFAOYSA-N- Molecular formula
- C8H5Cl2NO
- Average molar mass
- 202.03 g/mol
- Monoisotopic mass
- 200.9748192
Names & identifiers
- Preferred name
- 2-(2,3-Dichlorophenyl)-2-hydroxyacetonitrile
- IUPAC
- 2-(2,3-dichlorophenyl)-2-hydroxyacetonitrile
- English name
- (2,3-dichloro)hydroxyacetonitrile
- Molecular formula
- C8H5Cl2NO
- Molecular weight
- 202.0374
Names & synonyms
2-(2,3-dichlorophenyl)-2-hydroxyacetonitrile93842-97-8(2,3-Dichloro)hydroxyacetonitrileEINECS 299-074-7MFCD12169395DTXSID10917519VMBJRKFGAMINPT-UHFFFAOYSA-NAKOS009471646(2,3-Dichlorophenyl)(hydroxy)acetonitrile2-(2,3-dichlorophenyl)-2-hydroxy-acetonitrileW152272,3-Dichloro-α-hydroxybenzeneacetonitrile
Show more names
2,3-Dichloro-α-hydroxybenzeneacetonitrileBenzeneacetonitrile, 2,3-dichloro-α-hydroxy-2-(2,3-DICHLOROPHENYL)-2-HYDROXYACETONITRILE(WX191374)
Database identifiers
- CAS
93842-97-8- PubChem CID
- 43436632
- DTXSID
DTXSID10917519- EC Number
- 299-074-7
- Nikkaji
- J320.566E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Boiling point
- 341 · 341.0±37.0 °C(Predicted)
- Density
- 1.466 · 1.466±0.06 g/cm3(Predicted)
- pka
- 9.83 · 9.83±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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