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Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide

CAS
942047-62-3
Catalog Number
ACM942047623
Category
Other Products
Molecular Weight
272.292225334
Molecular Formula
C11H8D3NO5S

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Specification

Synonyms
METHYL-4-HYDROXY-2-METHYL-D3-2H-1,2-BENZOTHIAZINE-3-CARBOXYLATE 1,1-DIOXIDE
Appearance
Off-White Solid with Yellow Tinge
What is the molecular formula of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The molecular formula is C11H11NO5S.

What is the molecular weight of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The molecular weight is 272.29 g/mol.

What is the IUPAC name of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The IUPAC name is methyl 4-hydroxy-1,1-dioxo-2-(trideuteriomethyl)-1λ 6 ,2-benzothiazine-3-carboxylate.

What is the InChI of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The InChI is InChI=1S/C11H11NO5S/c1-12-9(11(14)17-2)10(13)7-5-3-4-6-8(7)18(12,15)16/h3-6,13H,1-2H3/i1D3.

What is the InChIKey of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The InChIKey is NGHIOTWSWSQQNT-FIBGUPNXSA-N.

What is the canonical SMILES of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The canonical SMILES is CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)OC.

What is the CAS number of Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide?

The CAS number is 942047-62-3.

How many hydrogen bond donor counts does Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does Methyl-4-hydroxy-2-methyl-d3-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide have?

It has 6 hydrogen bond acceptor counts.

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