Einecs 281-415-6
Basic information
- CAS
83949-55-7- Standard SMILES
Cc1nn(-c2ccccc2)c(=O)[c-]1N=Nc1cc([N+](=O)[O-])ccc1O.Cc1nn(-c2ccccc2)c(=O)[c-]1N=Nc1ccccc1C(=O)O.NCCO.[Cr].[H+]- InChIKey
LYUHTNLWSKDGMD-UHFFFAOYSA-O- Molecular formula
- C35H33CrN10O8-
- Average molar mass
- 773.7 g/mol
- Monoisotopic mass
- 773.188788
Overview
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Names & identifiers
- Preferred name
- Einecs 281-415-6
- IUPAC
- 2-aminoethanol;chromium;hydron;4-[(2-hydroxy-5-nitrophenyl)diazenyl]-5-methyl-2-phenylpyrazol-4-id-3-one;2-[(3-methyl-5-oxo-1-phenylpyrazol-4-id-4-yl)diazenyl]benzoic acid
Names & synonyms
EINECS 281-415-683949-55-7
Database identifiers
- CAS
83949-55-7- PubChem CID
- 91844571
- EC Number
- 281-415-6
Properties
Computed structural properties
- Topological polar surface area
- 264 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 17
- Rotatable bonds
- 3
- Heavy atoms
- 54
- Formal charge
- -1
- Complexity
- 1,350
Related reactions
0 records
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Compound notes
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