ST51001883
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Basic information
- CAS
24457-00-9- Standard SMILES
CC(C)(C)C1=CC(C(C)(C)C)=C([N+](=O)[O-])C(=O)C1=O- InChIKey
MXGLSZOKCUOVNO-UHFFFAOYSA-N- Molecular formula
- C14H19NO4
- Average molar mass
- 265.3 g/mol
- Monoisotopic mass
- 265.13140809
Names & identifiers
- Preferred name
- ST51001883
- IUPAC
- 4,6-ditert-butyl-3-nitrocyclohexa-3,5-diene-1,2-dione
- English name
- 4,6-Di-tert-butyl-3-nitro-1,2-benzoquinone
- Molecular formula
- C14H19NO4
- Molecular weight
- 265.3
Names & synonyms
24457-00-9ST51001883DTXSID10336584RefChem:381777DTXCID602876734,6-di-tert-butyl-3-nitrocyclohexa-3,5-diene-1,2-dioneo-Benzoquinone, 4,6-di-tert-butyl-3-nitro-4,6-di(tert-butyl)-3-nitro-1,2-benzoquinone3,5-Cyclohexadiene-1,2-dione, 4,6-bis(1,1-dimethylethyl)-3-nitro-SCHEMBL396879CCG-2541AKOS024367845
Show more names
4,6-Di-tert-butyl-3-nitro-1,2-benzoquinone
DB-3159924,6-di(t-butyl)-3-nitro-1,2-benzoquinone4,6-di-t-butyl-3-nitro-1,2-ben-zoquinone4,6-Ditert-butyl-3-nitrobenzo-1,2-quinone #AB00080588-014,6-bis(tert-butyl)-3-nitrocyclohexa-3,5-diene-1,2-dione
Database identifiers
- CAS
24457-00-9- PubChem CID
- 534779
- DTXSID
DTXSID10336584- Nikkaji
- J132.856E
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 80 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 519
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Related reactions
21 records
Compound notes
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