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2-methyl-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide

HCID 7601754
NotesReactions

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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5510-10-1
Standard SMILES
CN1CC(=O)c2ccccc2S1(=O)=O
InChIKey
CPIFFCMMBZLKDK-UHFFFAOYSA-N
Molecular formula
C9H9NO3S
Average molar mass
211.24 g/mol

Names & identifiers

Preferred name
2-methyl-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide
IUPAC
2-methyl-1,1-dioxo-3H-1λ6,2-benzothiazin-4-one
English name
2-methyl-1,1-dioxo-3H-1$l^{6},2-benzothiazin-4-one
Molecular formula
C9H9NO3S
Molecular weight
211.24

Names & synonyms

5510-10-12-methyl-2H-benzo[e][1,2]thiazin-4(3H)-one 1,1-dioxide2-methyl-3,4-dihydro-2H-1lambda6,2-benzothiazine-1,1,4-trione2-methyl-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide2-Methyl-2,3-dihydro-4H-benzo[e][1,2]thiazin-4-one 1,1-dioxide2-Methyl-2H-1,2-benzothiazin-4(3H)-one 1,1-dioxide2-methyl-1,1-dioxo-3H-1lambda6,2-benzothiazin-4-one2-methyl-3,4-dihydro-2H-1??,2-benzothiazine-1,1,4-trione2,3-Dihydro-2-methyl-4H-1,2-benzothiazin-4-one 1,1-Dioxide2-methyl-3,4-dihydro-2H-1lambda,2-benzothiazine-1,1,4-trioneMeloxicam Impurity 27starbld0027104
Show more names
Piroxicam Impurity 72-methyl-1,1-dioxo-3H-1$l^{6},2-benzothiazin-4-one4H-1,2-Benzothiazin-4-one, 2,3-dihydro-2-methyl-, 1,1-dioxide
SCHEMBL498521CHEMBL423532CPIFFCMMBZLKDK-UHFFFAOYSA-NBBL035746STK604819AKOS005227697VS-13212CS-0092025

Properties

Computed structural propertiesFilling in

XLogP
0.7
Topological polar surface area
62.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
14
Formal charge
0
Complexity
344

Physicochemical properties

Melting point
107.5 · 107.5-108.5 °C
Boiling point
386.2 · 386.2±45.0 °C(Predicted)
Density
1.404 · 1.404±0.06 g/cm3(Predicted)
solubility
Chloroform (Slightly), Methanol (Slightly)
form
Solid
pka
-8.15 · -8.15±0.20(Predicted)
color
Yellow to Dark Yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Applications

Uses2-Methyl-2H-1,2-benzothiazin-4(3H)-one 1,1-Dioxide is an intermediate used in the synthesis of Amido Methyl Meloxicam (A576790), which is an impurity of Meloxicam (M216100).

Suppliers10 total

艾吉析科技(上海)有限公司17717235263 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
湖北摩科生物科技有限公司18274848843 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
深圳市恒丰万达医药科技有限公司13986652530 · [email protected]
浙江皓格药业有限公司0573-88133976-8014 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
四川蓝励医药科技有限公司028-61186658 15881182642 · [email protected]
湖北摩科生物科技有限公司17320513646 · [email protected]

Related reactions

1 records
New reaction record
HRID 2119205 reaction equation
HRID 2119205As reactantuspto-grants-1987_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
5510-10-1
PubChem CID
7601754
ChEMBL
CHEMBL423532
EC Number
879-881-6