Basic information
- CAS
15206-39-0- Standard SMILES
CC(C)c1cc(N=O)cc(C(C)C)c1O- InChIKey
ZPXWXMJFBGTNTA-UHFFFAOYSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.12592879
Names & identifiers
- Preferred name
- 2,6-Diisopropyl-4-nitrosophenol
- IUPAC
- 4-nitroso-2,6-di(propan-2-yl)phenol
Names & synonyms
15206-39-02,6-diisopropyl-4-nitrosophenolMLS002707267NSC122930SCHEMBL9877273CHEMBL1884000DTXSID20934414ZPXWXMJFBGTNTA-UHFFFAOYSA-NNSC-122930SMR001574661oxyimino-2,6-diisopropylcyclohexa-2,5-dien-1-one4-(Hydroxyimino)-2,6-di(propan-2-yl)cyclohexa-2,5-dien-1-one
Database identifiers
- CAS
15206-39-0- PubChem CID
- 275841
- ChEMBL
CHEMBL1884000
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 198
Related reactions
1 records
Compound notes
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