3-Chloro-4-nitrosophenol
Basic information
- CAS
13362-36-2- Standard SMILES
O=Nc1ccc(O)cc1Cl- InChIKey
QICIMORRIZBBMK-UHFFFAOYSA-N- Molecular formula
- C6H4ClNO2
- Average molar mass
- 157.55 g/mol
- Monoisotopic mass
- 156.9930561
Names & identifiers
- Preferred name
- 3-Chloro-4-nitrosophenol
- IUPAC
- 3-chloro-4-nitrosophenol
- English name
- 3-Chloro-4-(hydroxyimino)-2,5-cyclohexadien-1-one
- Molecular formula
- C6H4ClNO2
- Molecular weight
- 157.55
Names & synonyms
3-chloro-4-nitrosophenol13362-36-23-Chloro-4-hydroxyimino-2,5-cyclohexadiene-1-one40140-91-8p-Benzoquinone, 2-chloro-, 1-oximep-Benzoquinone, 3-chloro-, 1-oximeNSC 2396502,5-Cyclohexadien-1-one, 3-chloro-4-hydroxyimino-BRN 31267702,5-Cyclohexadiene-1,4-dione, 2-chloro-, 1-oxime3-Chloro-4-(hydroxyimino)-2,5-cyclohexadien-1-oneNSC239650
Show more names
4-nitroso-3-chlorophenol3-Chloro-4-(hydroxyimino)cyclohexa-2,5-dien-1-oneWLN: L6V DYJ CG DUNQ2, 3-chloro-4-hydroxyimino-SCHEMBL9077264CHEMBL3276926DTXSID309282082,4-dione, 2-chloro-, 1-oxime
Database identifiers
- CAS
13362-36-2- PubChem CID
- 99848
- ChEMBL
CHEMBL3276926- Nikkaji
- J48.611F、J801.780H
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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