Methylthiomethyl phenyl sulfone
Grundinformationen
- CAS
59431-14-0- Standard-SMILES
CSCS(=O)(=O)c1ccccc1- InChIKey
XBGGZYQBIQAYII-UHFFFAOYSA-N- Summenformel
- C8H10O2S2
- Durchschnittliche Molmasse
- 202,3 g/mol
- Monoisotopische Masse
- 202,0122219
Namen und Bezeichner
- Bevorzugter Name
- Methylthiomethyl phenyl sulfone
- IUPAC
- methylsulfanylmethylsulfonylbenzene
- Englischer Name
- METHYLTHIOMETHYL PHENYL SULFONE
- Summenformel
- C8H10O2S2
- Molmasse
- 202.29
Namen und Synonyme
Methylthiomethyl phenyl sulfone59431-14-0methylsulfanylmethylsulfonylbenzeneDTXSID00349143RefChem:818722DTXCID60300215622-953-7Methyl((phenylsulfonyl)methyl)sulfane[(methylthiomethyl)sulfonyl]benzeneSCHEMBL730444SCHEMBL11565035MFCD00075517
Weitere Namen anzeigen
LABOTEST-BB LT00452176
SBB057692{[(methylthio)methyl]sulfonyl}benzene1-((Methylthio)methylsulfonyl)benzeneMethylthiomethyl phenyl sulfone, 99%AKOS024370876[(Methylsulfanyl)methanesulfonyl]benzeneAS-87519benzene, [[(methylthio)methyl]sulfonyl]-
Datenbank-Bezeichner
- CAS
59431-14-0- PubChem CID
- 643313
- DTXSID
DTXSID00349143- EC Number
- 622-953-7
- Nikkaji
- J1.189.638C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,9
- Polarare Oberfläche (TPSA)
- 67,8 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 210
Physikochemische Eigenschaften
- Schmelzpunkt
- 85 · 85-87 °C (lit.)
- InChI
- 1S/C8H10O2S2/c1-11-7-12(9,10)8-5-3-2-4-6-8/h2-6H,7H2,1H3
- InChIKey
- XBGGZYQBIQAYII-UHFFFAOYSA-N
- SMILES
- CSCS(=O)(=O)c1ccccc1
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- wgk
- 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-37/39
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
VerwendenMethylthiomethyl phenyl sulfone may be employed:as nucleophilic and electrophilic building block, in the asymmetric synthesis of 6-N-benzoyl-5′-O-benzyl-2′-deoxyadenosine and its anomerin the synthesis of various multidentate methylthio arylethynes (MTA) derivativesas starting reagent in the preparation of methylthio arylbutadiynes (Ar-C=C-C=C-SCH3)
Anbieter10 Anbieter
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Aladdin Scientific[email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
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