CAS
93920-34-4 Purity
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93920-34-4 Purity
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![2,5-Dichloro-4-[4-[(2-chlorophenyl)azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulfonic acid](https://resource.alfa-chemistry.com/structure/93920-40-2.gif)
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5-Bromo-2-[1-(carboxymethyl)-3-(2-methoxyphenyl)triazen-2-yl]benzoic acid,sodium salt
CAS
93920-39-9
Catalog Number
ACM93920399
Category
Other Products
Molecular Weight
453.175060 [g/mol]
Molecular Formula
C16H13BrN3Na2O5+
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Specification
Synonyms
EINECS 300-125-3, 5-Bromo-2-(1-(carboxymethyl)-3-(2-methoxyphenyl)triazen-2-yl)benzoic acid, sodium salt, 93920-39-9
IUPAC Name
disodium 5-bromo-2-[(2-methoxyanilino)-(2-oxido-2-oxoethyl)iminoazaniumyl]benzoate
InChI Key
HKJWCVRCKNFXAV-UHFFFAOYSA-M
Exact Mass
451.98300
H-Bond Acceptor
7
H-Bond Donor
1
What is the molecular formula of the compound?
The molecular formula of the compound is C16H13BrN3Na2O5.
What is the molecular weight of the compound?
The molecular weight of the compound is 453.17 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is disodium; 5-bromo-2-[carboxylatomethylimino-(2-methoxyanilino)azaniumyl]benzoate.
What is the InChI key of the compound?
The InChI key of the compound is HKJWCVRCKNFXAV-UHFFFAOYSA-M.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 7 hydrogen bond acceptor counts.
What is the exact mass of the compound?
The exact mass of the compound is 451.98340 g/mol.
How many rotatable bond counts does the compound have?
The compound has 5 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 117 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
93921-16-5 Purity
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93921-16-5 Purity
96%
