CAS 10438-96-7 N-Methylsulfamoyl chloride (HCID 11789235)

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Grundinformationen

CAS: 10438-96-7
Standard-SMILES: CNS(=O)(=O)Cl
InChIKey: UJJUEJRWNWVHCM-UHFFFAOYSA-N
Summenformel: CH4ClNO2S
Durchschnittliche Molmasse: 129,57 g/mol
Monoisotopische Masse: 128,9651272

Namen und Bezeichner

Bevorzugter Name: N-Methylsulfamoyl chloride
IUPAC: N-methylsulfamoyl chloride
Englischer Name: Methylsulfamoyl chloride
Summenformel: CH4ClNO2S
Molmasse: 129.57

Namen und Synonyme

10438-96-7N-methylsulfamoyl chlorideRefChem:830799600-562-2METHYLSULFAMOYL CHLORIDEMFCD00126938MethylsulfamoylchlorideSulfamoyl chloride, methyl-methyl sulfamoyl chloridemethylaminosulfonyl chlorideMesulfamoyl chlorideMethylsulfamoylchlorid

Weitere Namen anzeigen

N-methyl-Sulfamoyl chloride(MethylsulfaMoyl)chloranuideSulfamoyl chloride, N-methyl-

methylsulfamyl choridemethylsulfamyl chlorideMethylsulphamoyl chlorideN-methylsulfamoylchloridemethylsulfamic acid chlorideN-methyl sulfamoyl chlorideN-Methylaminosulfonyl chlorideSCHEMBL573159

Datenbank-Bezeichner

CAS: 10438-96-7
PubChem CID: 11789235
DTXSID: DTXSID20472720
EC Number: 600-562-2

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,1
Polarare Oberfläche (TPSA): 54,6 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 1
Schwere Atome: 6
Formalladung: 0
Komplexität: 110

Physikochemische Eigenschaften

Siedepunkt: 188.9 · 188.9±23.0℃ (760 Torr)
Dichte: 1.501 · 1.501±0.06 g/cm3 (20 ºC 760 Torr)
Flammpunkt: 68 · 68.0±22.6℃
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 7.91 · 7.91±0.40(Predicted)
Aggregatzustand: solid
InChI: InChI=1S/CH4ClNO2S/c1-3-6(2,4)5/h3H,1H3
InChIKey: UJJUEJRWNWVHCM-UHFFFAOYSA-N
SMILES: S(Cl)(NC)(=O)=O

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H330 (92.9%): Fatal if inhaled [Danger Acute toxicity, inhalation]；H351 (92.9%): Suspected of causing cancer [Warning Carcinogenicity]

P203, P260, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P318, P320, P321, P330, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 4 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.