CAS
94108-94-8 Purity
96%
94108-94-8 Purity
96%
![3-[[4-[[4-[Ethyl[(4-sulphophenyl)methyl]amino]phenyl]azo]-1-naphthyl]azo]benzenesulphonic acid,sodium salt](https://resource.alfa-chemistry.com/structure/94109-01-0.gif)
![4,5-Dihydro-4-[(2-methoxy-5-methylphenyl)azo]-3-methyl-5-oxo-1H-pyrazole-1-carboxamidine monoacetate](https://resource.alfa-chemistry.com/structure/94109-04-3.gif)
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Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate
CAS
94109-02-1
Catalog Number
ACM94109021
Category
Other Products
Molecular Weight
475.795610 [g/mol]
Molecular Formula
C16H12ClN5O7SNa
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Specification
Synonyms
EINECS 302-440-1, CID9554078, 94109-02-1, Sodium 4-chloro-3-(4,5-dihydro-4-((2-hydroxy-4-nitrophenyl)azo)-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonate
IUPAC Name
sodium 4-chloro-3-[3-methyl-4-[(2E)-2-(4-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)hydrazinyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonate
Canonical SMILES
CC1=NN(C(=O)C1NN=C2C=CC(=CC2=O)[N+](=O)[O-])C3=C(C=CC(=C3)S(=O)(=O)[O-])Cl.[Na+]
InChI Key
KZTKJNOSXHJJNG-XMMWENQYSA-M
EC Number
302-440-1
H-Bond Acceptor
10
H-Bond Donor
1
What is the molecular formula of Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
The molecular formula is C16H11ClN5NaO7S.
What are some synonyms for Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
Some synonyms include SODIUM 4-CHLORO-3-[4,5-DIHYDRO-4-[(2-HYDROXY-4-NITROPHENYL)AZO]-3-METHYL-5-OXO-1H-PYRAZOL-1-YL]BENZENESULFONATE.
What is the molecular weight of Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
The molecular weight is 475.8 g/mol.
What is the IUPAC Name of Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
The IUPAC name is sodium;4-chloro-3-[4-[(2-hydroxy-4-nitrophenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonate.
What is the InChIKey of Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
The InChIKey is SKTQCDDLKDZUTB-UHFFFAOYSA-M.
How many Hydrogen Bond Donors are in Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
There is 1 Hydrogen Bond Donor.
How many Hydrogen Bond Acceptors are in Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
There are 10 Hydrogen Bond Acceptors.
What is the Topological Polar Surface Area of Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
The Topological Polar Surface Area is 189 Ų.
How many Defined Atom Stereocenter Count are in Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
There are 0 Defined Atom Stereocenter Count.
Is the Compound Is Canonicalized for Sodium 4-chloro-3-[4,5-dihydro-4-[(2-hydroxy-4-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonate?
Yes, the Compound Is Canonicalized.
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CAS
94108-95-9 Purity
96%
94108-95-9 Purity
96%
