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

Name
Methyl 4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide
EINECS 252-600-9
CAS No. 35511-14-9
Article Data23
CAS DataBase
Density 1.568 g/cm³
Solubility
Melting Point 168-170°C
Formula C₁₀H₉NO₅S
Boiling Point 447.025 °C at 760 mmHg
Molecular Weight 255.251
Flash Point 224.153 °C
Transport Information
Appearance
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Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Hydroxy-2H-1,2-benzothiazine-3-carboxylicacid methyl ester 1,1-dioxide;Methyl4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide;
PSA 101.08000
LogP 1.78770

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

The CAS register number of Methyl 4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide is 35511-14-9. It also can be called as 2H-1,2-Benzothiazine-3-carboxylicacid, 4-hydroxy-, methyl ester, 1,1-dioxide and the IUPAC name about this chemical is (3E)-3-[hydroxy(methoxy)methylidene]-1,1-dioxo-1$l^{6},2-benzothiazin-4-one. The molecular formula about this chemical is C₁₀H₉NO₅S and molecular weight is 255.25. It belongs to the following product categories, such as Heterocyclic Compounds; Heterocycles; Intermediates & Fine Chemicals; Pharmaceuticals; Sulfur & Selenium Compounds and so on.

Physical properties about Methyl 4-hydroxy-2H-1,2-benzothiazine-3-carboxylate 1,1-dioxide are: (1)ACD/LogP: 1.75; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 3; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 6; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 101.08Å²; (10)Index of Refraction: 1.639; (11)Molar Refractivity: 58.54 cm³; (12)Molar Volume: 162.747 cm³; (13)Polarizability: 23.207x10^-24cm³; (14)Surface Tension: 65.617 dyne/cm; (15)Enthalpy of Vaporization: 74.328 kJ/mol; (16)Boiling Point: 447.025 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)C=2NS(=O)(=O)c1ccccc1C=2O
(2)InChI: InChI=1/C10H9NO5S/c1-16-10(13)8-9(12)6-4-2-3-5-7(6)17(14,15)11-8/h2-5,11-12H,1H3
(3)InChIKey: GEUURTZIEGFZAG-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C10H9NO5S/c1-16-10(13)8-9(12)6-4-2-3-5-7(6)17(14,15)11-8/h2-5,11-12H,1H3
(5)Std. InChIKey: GEUURTZIEGFZAG-UHFFFAOYSA-N

Product Name

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

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

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