2,6-Naphthalenedisulfonic acid, 3,7-di-tert-butyl-, compd. with 6-(dimethylamino)-4,4-diphenyl-3-hexanone
Basic information
- CAS
103442-82-6- Standard SMILES
CC(C)(C)c1cc2cc(S(=O)(=O)O)cc(C(C)(C)C)c2cc1S(=O)(=O)O.CCC(=O)C(CCN(C)C)(c1ccccc1)c1ccccc1- InChIKey
TZCJQCVGPYTLJR-UHFFFAOYSA-N- Molecular formula
- C38H49NO7S2
- Average molar mass
- 695.9 g/mol
- Monoisotopic mass
- 695.29504525
Names & identifiers
- Preferred name
- 2,6-Naphthalenedisulfonic acid, 3,7-di-tert-butyl-, compd. with 6-(dimethylamino)-4,4-diphenyl-3-hexanone
- IUPAC
- 3,8-ditert-butylnaphthalene-2,6-disulfonic acid;6-(dimethylamino)-4,4-diphenylhexan-3-one
Names & synonyms
2,6-Di-tert-butylnaphthalinedisulfonic acid 1-dimethylamino-3,3-diphenylhexanone-(4)103442-82-6DTXSID60145860RefChem:248629DTXCID60683513,8-Di-tert-butylnaphthalene-2,6-disulfonic acid--6-(dimethylamino)-4,4-diphenylhexan-3-one (1/1)
Database identifiers
- CAS
103442-82-6- PubChem CID
- 59755
- DTXSID
DTXSID60145860
Properties
Computed structural properties
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,040
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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