CAS
93803-27-1 Purity
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93803-27-1 Purity
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![Trisodium 4-[[8-amino-7-[[4'-[(2-amino-4-hydroxyphenyl)azo][1,1'-biphenyl]-4-yl]azo]-1-hydroxy-3,6-disulphonato-2-naphthyl]azo]benzoate](https://resource.alfa-chemistry.com/structure/93803-39-5.gif)
![Benzenesulfonic acid,2-[[4-[[2-hydroxy-5-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]phenyl]amino]-5-nitro-,disodium salt(9ci)](https://resource.alfa-chemistry.com/structure/93803-40-8.gif)
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Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate
CAS
93803-32-8
Catalog Number
ACM93803328
Category
Other Products
Molecular Weight
729.598328 [g/mol]
Molecular Formula
C26H18N3Na3O12S3
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Specification
Synonyms
AGN-PC-00IZQS, CTK5H3155, 93803-32-8, TRISODIUM 4-[[1-HYDROXY-8-[[1-OXO-3-(PHENYLSULPHONYL)PROPYL]AMINO]-3,6-DISULPHONATO-2-NAPHTHYL]AZO]BENZOATE, AG-H-83530, trisodium;4-[(2E)-2-[8-[3-(benzenesulfonyl)propanoylamino]-1-oxo-3,6-disulfonatonaphthalen-2-ylidene]hydrazinyl]benzoate
IUPAC Name
trisodium;4-[2-[8-[3-(benzenesulfonyl)propanoylamino]-1-oxo-3,6-disulfonatonaphthalen-2-ylidene]hydrazinyl]benzoate
Canonical SMILES
C1=CC=C(C=C1)S(=O)(=O)CCC(=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C(=C3[O-])N=NC4=CC=C(C=C4)C(=O)[O-])S(=O)(=O)O)[O-].[Na+].[Na+].[Na+]
InChI Key
NFWHXRJMPUXBIZ-UHFFFAOYSA-K
EC Number
298-302-2
H-Bond Acceptor
14
H-Bond Donor
2
What is the molecular formula of Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The molecular formula is C26H18N3Na3O12S3.
When was Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate created?
Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate was created on January 17, 2019.
What is the molecular weight of Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The molecular weight is 729.6 g/mol.
What are the synonyms for Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The synonyms include EINECS 298-302-2 and 93803-32-8.
How many hydrogen bond donor counts are in Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
There are 2 hydrogen bond donor counts.
What is the InChIKey of Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The InChIKey is ZSKWXQUHWGAJEH-UHFFFAOYSA-K.
How many heavy atoms are in Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
There are 47 heavy atoms.
What is the topological polar surface area of Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The topological polar surface area is 288 Ų.
What is the formal charge of Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
The formal charge is 0.
How many rotatable bonds are in Trisodium 4-[[1-hydroxy-8-[[1-oxo-3-(phenylsulfonyl)propyl]amino]-3,6-disulfonato-2-naphthyl]azo]benzoate?
There are 8 rotatable bonds.
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