Benzonitrile, 2,6-dichloro-4-hydroxy-
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Basic information
- CAS
3336-19-4- Standard SMILES
N#Cc1c(Cl)cc(O)cc1Cl- InChIKey
KEVQPVCRSMUYCT-UHFFFAOYSA-N- Molecular formula
- C7H3Cl2NO
- Average molar mass
- 188.01 g/mol
- Monoisotopic mass
- 186.95916908
Names & identifiers
- Preferred name
- Benzonitrile, 2,6-dichloro-4-hydroxy-
- IUPAC
- 2,6-dichloro-4-hydroxybenzonitrile
- English name
- 2,6-Dichloro-4-hydroxybenzonitrile
- Molecular weight
- 0
Names & synonyms
2,6-Dichloro-4-hydroxybenzonitrile4-Hydroxydichlobenil3336-19-4BRN 2096238BENZONITRILE, 2,6-DICHLORO-4-HYDROXY-3-10-00-00362 (Beilstein Handbook Reference)DTXSID40186973RefChem:327981DTXCID80109464SCHEMBL1900659KEVQPVCRSMUYCT-UHFFFAOYSA-N4-hydroxy-2,6-dichlorobenzonitrile
Database identifiers
- CAS
3336-19-4- PubChem CID
- 18747
- DTXSID
DTXSID40186973- Nikkaji
- J42.011E
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 176
Related reactions
1 records
Compound notes
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