methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate hydrochloride

HCID 56777038

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Grundinformationen

CAS: 58281-79-1
Standard-SMILES: COC(=O)[C@@H]1C[C@H](F)CN1.Cl
InChIKey: SJLXDUCYXKAYFC-FHAQVOQBSA-N
Summenformel: C6H11ClFNO2
Durchschnittliche Molmasse: 183,61 g/mol

Namen und Bezeichner

Bevorzugter Name: methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate hydrochloride
IUPAC: methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate;hydrochloride
Englischer Name: (2S,4S)-4-Fluoro-2-methoxycarbonyl-pyrrolidine HCl
Summenformel: C6H10FNO2.ClH
Molmasse: 183.61

Namen und Synonyme

58281-79-1methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate hydrochlorideRefChem:812214830-432-2(2S,4S)-Methyl 4-fluoropyrrolidine-2-carboxylate hydrochloride(2S,4S)-Methyl 4-fluoropyrrolidine-2-carboxylate HClMFCD07374353methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate;hydrochlorideCIS-4-FLUORO-L-PROLINE METHYL ESTER HYDROCHLORIDESCHEMBL1493678(2S,4S)-4-FLUORO-2-METHOXYCARBONYL-PYRROLIDINE HCLAKOS015849647

Weitere Namen anzeigen

(4S)-4-Fluoro-L-proline Methyl ester HClCIS-4-FLUORO-PYRROLIDINE-2-CARBOXYLIC ACID METHYL ESTER(4S)-4-fluoro-L-Proline methyl ester hydrochloride (1:1)(2S,4S)-4-Fluoro-2-methoxycarbonylpyrrolidinehydrochlorideL-Proline, 4-fluoro-, methyl ester, hydrochloride (1:1), (4S)-

EN300-193075cis-4-Fluoro-L-proline methyl ester hydrochloride, AldrichCPR(2S,4S)-4-fluoro-2-(methoxycarbonyl)pyrrolidine hydrochloride(2S,4S)-Methymethyl (4s)-4-fluoro-l-prolinate hydrochlorideWLZ4242Methyl (2S,4S)-4-fluoropyrrolidine-2-carboxylate hydrochlorideAKOS015950323

Datenbank-Bezeichner

CAS: 58281-79-1
PubChem CID: 56777038
EC Number: 830-432-2

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 38,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 2
Schwere Atome: 11
Formalladung: 0
Komplexität: 140

Physikochemische Eigenschaften

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P271, P280, P301+P317, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.