3-Mercapto-N-methylpropanamide

HCID 642906CAS 52334-99-3

Grundinformationen

Standard-SMILES
CNC(=O)CCS
InChIKey
VYQTZFNKSHBQKY-UHFFFAOYSA-N
Summenformel
C4H9NOS
Durchschnittliche Molmasse
119,19 g/mol
Monoisotopische Masse
119,04048508

Namen und Bezeichner

Bevorzugter Name
3-Mercapto-N-methylpropanamide
IUPAC
N-methyl-3-sulfanylpropanamide
Englischer Name
Propanamide, 3-mercapto-N-methyl-
Summenformel
C4H9NOS
Molmasse
119.19

Namen und Synonyme

3-Mercapto-N-methylpropanamide52334-99-3Propanamide, 3-mercapto-N-methyl-N-Methyl 3-mercaptopropionamideDTXSID20886000RefChem:94543methyl-3-mercaptopropionamideDTXCID901025351610-826-9InChI=1/C4H9NOS/c1-5-4(6)2-3-7/h7H,2-3H2,1H3,(H,5,6N-methyl-3-sulfanylpropanamide3-mercapto-N-methyl propanamide
Weitere Namen anzeigen
thiol-3 N-methylpropanamide
MFCD01756800SCHEMBL1146799SCHEMBL3896924SCHEMBL5501209N-methyl-3-sulfanyl-propanamideN-methyl-(3-mercapto)propionamiden-methyl-(3-mercapto)-propionamideAKOS006279331

Datenbank-Bezeichner

CAS
52334-99-3
PubChem CID
642906
DTXSID
DTXSID20886000
EC Number
610-826-9
Nikkaji
J422.600C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,2
Polarare Oberfläche (TPSA)
30,1 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
2
Schwere Atome
7

Physikochemische Eigenschaften

storage temp.
Sealed in dry,Room Temperature
EPA chemische Informationen
3 · Propanamide, 3-mercapto-N-methyl- (52334-99-3)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (97.9%): Toxic if swallowed [Danger Acute toxicity, oral];H312+H332 (39.4%): Harmful in contact with skin or if inhaled [Warning Acute toxicity, dermal; acute toxicity, inhalation];H312 (97.9%): Harmful in contact with skin [Warning Acute toxicity, dermal];H332 (97.9%): Harmful if inhaled [Warning Acute toxicity, inhalation]

P261, P264, P270, P271, P280, P301+P316, P302+P352, P304+P340, P317, P321, P330, P362+P364, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 94 reports by companies from 3 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

Regulatory Information · 2 Einträge

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 16-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26584

Hazard Classes and CategoriesAcute Tox. 3 (97.9%);Acute Tox. 4 (97.9%);Acute Tox. 4 (97.9%)

Regulatorische Informationen

Regulatory Information · 2 Einträge

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 16-08-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/26584

Sicherheitsdaten

tsca
TSCA listed

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationPropanamide, 3-mercapto-N-methyl-: INACTIVE

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