HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Chromate(3-), [4-amino-5-(hydroxy-kappaO)-6-[2-[2-(hydroxy-kappaO)-4-nitrophenyl]diazenyl-kappaN1]-1,7-naphthalenedisulfonato(4-)][2-[2-[5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl]diazenyl-kappaN1]-3-(oxo-kappaO)-N-phenylbutanamidato(2-)]-, sodium (1:3)

HCID 170852051
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
212716-69-3
Standard SMILES
CC(O)=C(N=Nc1cc(S(N)(=O)=O)ccc1O)C(=O)Nc1ccccc1.Nc1ccc(S(=O)(=O)O)c2cc(S(=O)(=O)O)c(N=Nc3ccc([N+](=O)[O-])cc3[O-])c([O-])c12.[Cr].[Na+].[Na+].[Na+]
InChIKey
ULKLYOLSEGDGGG-UHFFFAOYSA-L
Molecular formula
C32H26CrN8Na3O15S3+
Average molar mass
979.8 g/mol
Monoisotopic mass
978.977788

Names & identifiers

Preferred name
Chromate(3-), [4-amino-5-(hydroxy-kappaO)-6-[2-[2-(hydroxy-kappaO)-4-nitrophenyl]diazenyl-kappaN1]-1,7-naphthalenedisulfonato(4-)][2-[2-[5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl]diazenyl-kappaN1]-3-(oxo-kappaO)-N-phenylbutanamidato(2-)]-, sodium (1:3)
IUPAC
trisodium;8-amino-2-[(4-nitro-2-oxidophenyl)diazenyl]-3,5-disulfonaphthalen-1-olate;chromium;3-hydroxy-2-[(2-hydroxy-5-sulfamoylphenyl)diazenyl]-N-phenylbut-2-enamide

Names & synonyms

Chromate(3-), (4-amino-5-(hydroxy-kappaO)-6-(2-(2-(hydroxy-kappaO)-4-nitrophenyl)diazenyl-kappaN1)-1,7-naphthalenedisulfonato(4-))(2-(2-(5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)diazenyl-kappaN1)-3-(oxo-kappaO)-N-phenylbutanamidato(2-))-, sodium (1:3)Chromate(3-), [4-amino-5-(hydroxy-kappaO)-6-[2-[2-(hydroxy-kappaO)-4-nitrophenyl]diazenyl-kappaN1]-1,7-naphthalenedisulfonato(4-)][2-[2-[5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl]diazenyl-kappaN1]-3-(oxo-kappaO)-N-phenylbutanamidato(2-)]-, sodium (1:3)RefChem:576624Chromate(3-), (4-amino-5-(hydroxy-kappaO)-6-((2-(hydroxy-kappaO)-4-nitrophenyl)azo-kappaN1)-1,7-naphthalenedisulfonato(4-))(2-((5-(aminosulfonyl)-2-(hydroxy-kappaO)phenyl)azo-kappaN1)-3-(oxo-kappaO)-N-phenylbutanamidato(2-))-, trisodiumChromate(3-), [4-amino-5-(hydroxy-.kappa.O)-6-[2-[2-(hydroxy-.kappa.O)-4-nitrophenyl]diazenyl-.kappa.N1]-1,7-naphthalenedisulfonato(4-)][2-[2-[5-(aminosulfonyl)-2-(hydroxy-.kappa.O)phenyl]diazenyl-.kappa.N1]-3-(oxo-.kappa.O)-N-phenylbutanamidato(2-)]-, sodium (1:3)212716-69-3

Database identifiers

CAS
212716-69-3
PubChem CID
170852051

Properties

Computed structural properties

Topological polar surface area
431 Ų
Hydrogen bond donors
7
Hydrogen bond acceptors
21
Rotatable bonds
9
Heavy atoms
62
Formal charge
1
Complexity
1,610

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Chemistry & industry

Uses & manufacturing

General Manufacturing Information · 1 item

Chromate(3-), [4-amino-5-(hydroxy-.kappa.O)-6-[2-[2-(hydroxy-.kappa.O)-4-nitrophenyl]diazenyl-.kappa.N1]-1,7-naphthalenedisulfonato(4-)][2-[2-[5-(aminosulfonyl)-2-(hydroxy-.kappa.O)phenyl]diazenyl-.kappa.N1]-3-(oxo-.kappa.O)-N-phenylbutanamidato(2-)]-, sodium (1:3): ACTIVE

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes