CAS
94134-32-4 Purity
96%
94134-32-4 Purity
96%
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Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate
CAS
94134-37-9
Catalog Number
ACM94134379
Category
Other Products
Molecular Weight
394.355960 [g/mol]
Molecular Formula
C16H14N2O8SNa
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Specification
Synonyms
EINECS 302-805-5, CID419140, NSC111121, Sodium 4-methoxy-3-((3-(3-nitrophenyl)-1,3-dioxopropyl)amino)benzenesulphonate, 94134-37-9
IUPAC Name
4-methoxy-3-[[3-(3-nitrophenyl)-3-oxopropanoyl]amino]benzenesulfonic acid
Canonical SMILES
COC1=C(C=C(C=C1)S(=O)(=O)[O-])NC(=O)CC(=O)C2=CC(=CC=C2)[N+](=O)[O-].[Na+]
InChI Key
GYMDXZVEVWMFOG-UHFFFAOYSA-N
Density
1.534g/cm³
EC Number
302-805-5
Exact Mass
417.03700
H-Bond Acceptor
8
H-Bond Donor
2
What is the molecular formula of Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The molecular formula is C16H13N2NaO8S.
What is the molecular weight of Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The molecular weight is 416.3 g/mol.
What are the synonyms for Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The synonyms are SODIUM 4-METHOXY-3-[[3-(3-NITROPHENYL)-1,3-DIOXOPROPYL]AMINO]BENZENESULFONATE.
When was Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate created?
It was created on December 5, 2007.
What is the InChIKey for Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The InChIKey is LMKXLWOKWIILGQ-UHFFFAOYSA-M.
How many hydrogen bond donor counts does Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate have?
It has 1 hydrogen bond donor count.
What is the hydrogen bond acceptor count for Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The hydrogen bond acceptor count is 8.
What is the exact mass of Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
The exact mass is 416.02903083 g/mol.
How many rotatable bond counts does Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate have?
It has 5 rotatable bond counts.
Is the compound canonicalized for Sodium 4-methoxy-3-[[3-(3-nitrophenyl)-1,3-dioxopropyl]amino]benzenesulfonate?
Yes, the compound is canonicalized.
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