(4R,6S)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno(2,3-b)thiopyran-4-ol
Grundinformationen
- CAS
147128-77-6- Standard-SMILES
C[C@H]1C[C@@H](O)c2ccsc2S1(=O)=O- InChIKey
NFUQUGUUAUVBMO-CAHLUQPWSA-N- Summenformel
- C8H10O3S2
- Durchschnittliche Molmasse
- 218,3 g/mol
- Monoisotopische Masse
- 218,00713618
Namen und Bezeichner
- Bevorzugter Name
- (4R,6S)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno(2,3-b)thiopyran-4-ol
- IUPAC
- (4R,6S)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-ol
- Englischer Name
- (4S,6S)-4H-Thieno[2,3-b]-thiopyran-4-ol-5,6-dihydro-6-methyl-7,7-dioxide
- Summenformel
- C8H10O3S2
- Molmasse
- 218.29
Namen und Synonyme
(4R,6S)-6-Methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-ol4H-Thieno[2,3-b]thiopyran-4-ol, 5,6-dihydro-6-methyl-, 7,7-dioxide, (4R,6S)-(4R,6S)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno(2,3-b)thiopyran-4-ol4H-Thieno(2,3-b)thiopyran-4-ol, 5,6-dihydro-6-methyl-, 7,7-dioxide, (4R,6S)-RefChem:403349604-572-8147128-77-6MFCD11035925(4R,6S)-5,6-Dihydro-4-hydroxy-6-methylthieno[2,3-b]thiopyran-7,7-dioxideDorzolamide Impurity 28162490-44-0(4R,6S)-4-Hydroxy-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran 7,7-dioxide
Weitere Namen anzeigen
Dorzolamide N-2Tizanidine Impurity 14Dorzolamide Impurity 17(4R,6S)-5,6-Dihydro-4-hydroxy-6-Methyl thieno2,3-b(4S,6S)-4H-Thieno[2,3-b]-thiopyran-4-ol-5,6-dihydro-6-methyl...
cis-4-Hydroxy-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran 7,7-dioxide(2S,4R)-4-hydroxy-2-methyl-2H,3H,4H-1lambda6-thieno[2,3-b]thiopyran-1,1-dioneNFUQUGUUAUVBMO-CAHLUQPWSA-NDorzolamide Impurity 2starbld00196696PA5ZSD6CWSCHEMBL3303040(4R,6R)-6-Methyl-5,6-dihydro-4H-thieno-[2,3-b]thiopyran-4-ol 7,7-dioxide
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,9
- Polarare Oberfläche (TPSA)
- 91 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 13
- Formalladung
- 0
- Komplexität
- 293
Physikochemische Eigenschaften
- Schmelzpunkt
- 154 · 154-155 °C
- Siedepunkt
- 433.3 · 433.3±45.0 °C(Predicted)
- Dichte
- 1.462 · 1.462
- storage temp.
- Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Sparingly), DMSO, Ethyl Acetate
- pka
- 13.06 · 13.06±0.40(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- InChI
- InChI=1S/C8H10O3S2/c1-5-4-7(9)6-2-3-12-8(6)13(5,10)11/h2-3,5,7,9H,4H2,1H3/t5-,7+/m0/s1
- InChIKey
- NFUQUGUUAUVBMO-CAHLUQPWSA-N
- SMILES
- C12SC=CC=1[C@H](O)C[C@H](C)S2(=O)=O
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (2 of 2) of all reports.
Not Classified
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 06-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26766
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- hs_code
- 2934999090
Chemie und Industrie
Anwendungen
Verwenden(4R,6S)-4H-Thieno[2,3-b]thiopyran-4-ol, 5,6-dihydro-6-methyl-,7,7-dioxide is an analog of topically-active carbonic anhydrase inhibitor MK-507 also commonly known as Dorzolamide (D535100).
Anbieter92 Anbieter
济南百隆化学有限公司[email protected] · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
青岛君之道生物技术有限公司0532-87118899 13918827946 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
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