CAS
94088-37-6 Purity
96%
94088-37-6 Purity
96%
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Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate
CAS
94088-41-2
Catalog Number
ACM94088412
Category
Other Products
Molecular Weight
320.296790 [g/mol]
Molecular Formula
C12H14N2O5SNa
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Specification
Synonyms
EINECS 302-041-2, 94088-41-2, Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulphonate
IUPAC Name
sodium (1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-hydroxymethanesulfonate
Canonical SMILES
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(O)S(=O)(=O)[O-].[Na+]
InChI Key
QSWGFQRUXYZFIS-UHFFFAOYSA-M
EC Number
302-041-2
Exact Mass
320.04400
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
The molecular formula is C12H13N2NaO5S.
When was Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate created?
It was created on February 5, 2008.
What is the molecular weight of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
The molecular weight is 320.30 g/mol.
What are some synonyms for Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
Some synonyms include EINECS 302-041-2, 94088-41-2, and DTXSID10916527.
What are some component compounds of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
Some component compounds include Sodium and ((1,5-Dimethyl-3-oxo-2-phenylpyrazol-4-yl)-hydroxymethanesulfonic acid).
What is the IUPAC name of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
The IUPAC name is sodium;(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-hydroxymethanesulfonate.
What is the InChIKey of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
The InChIKey is QSWGFQRUXYZFIS-UHFFFAOYSA-M.
How many hydrogen bond donor counts does Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate?
The topological polar surface area is 109 Å^2.
Is Sodium 2,3-dihydro-alpha-hydroxy-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-methanesulfonate a canonicalized compound?
Yes, it is a canonicalized compound.
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