Basic information
- CAS
72812-35-2- Standard SMILES
CCCCC(CC)COCCCN.O=C1C=CC(N([O-])[O-])=CC1=NN=C1C(=O)C=Cc2ccccc21.O=[N+]([O-])c1ccc([O-])c(N=Nc2c([O-])ccc3ccccc23)c1.[Cr+3].[H+]- InChIKey
PTYAKDNMRFWDLZ-UHFFFAOYSA-M- Molecular formula
- C43H44CrN7O9
- Average molar mass
- 854.8 g/mol
- Monoisotopic mass
- 854.260556
Names & identifiers
- Preferred name
- Chromate(1-), bis(1-(2-(2-(hydroxy-kappaO)-5-nitrophenyl)diazenyl-kappaN1)-2-naphthalenolato(2-)-kappaO)-, hydrogen, compd. with 3-((2-ethylhexyl)oxy)-1-propanamine (1:1:1)
- IUPAC
- chromium(3+);1-[[3-(dioxidoamino)-6-oxocyclohexa-2,4-dien-1-ylidene]hydrazinylidene]naphthalen-2-one;3-(2-ethylhexoxy)propan-1-amine;hydron;1-[(5-nitro-2-oxidophenyl)diazenyl]naphthalen-2-olate
Names & synonyms
EINECS 276-858-7RefChem:576248Chromate(1-), bis[1-[2-[2-(hydroxy-.kappa.O)-5-nitrophenyl]diazenyl-.kappa.N1]-2-naphthalenolato(2-)-.kappa.O]-, hydrogen, compd. with 3-[(2-ethylhexyl)oxy]-1-propanamine (1:1:1)SCHEMBL32670474Hydrogen bis(1-((2-hydroxy-5-nitrophenyl)azo)-2-naphtholato(2-))chromate(1-) , compound with 3-((2-ethylhexyl)oxy)propylamine (1:1)
Database identifiers
- CAS
72812-35-2- PubChem CID
- 175176
Properties
Computed structural properties
- Topological polar surface area
- 260 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 12
- Heavy atoms
- 60
- Formal charge
- 0
- Complexity
- 549
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationChromate(1-), bis[1-[2-[2-(hydroxy-.kappa.O)-5-nitrophenyl]diazenyl-.kappa.N1]-2-naphthalenolato(2-)-.kappa.O]-, hydrogen, compd. with 3-[(2-ethylhexyl)oxy]-1-propanamine (1:1:1): ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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