ethyl N-(2-hydroxyethyl)carbamate

HCID 223805CAS 5602-93-7

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Grundinformationen

Standard-SMILES: CCOC(=O)NCCO
InChIKey: IDWDPUULTDNNBY-UHFFFAOYSA-N
Summenformel: C5H11NO3
Durchschnittliche Molmasse: 133,15 g/mol
Monoisotopische Masse: 133,07389321

Namen und Bezeichner

Bevorzugter Name: ethyl N-(2-hydroxyethyl)carbamate
IUPAC: ethyl N-(2-hydroxyethyl)carbamate
Englischer Name: Ethyl N-(2-hydroxyethyl)-carbamate
Summenformel: C5H11NO3
Molmasse: 133.15

Namen und Synonyme

ethyl N-(2-hydroxyethyl)carbamateRefChem:596292690-609-35602-93-7ethyl (2-hydroxyethyl)carbamateethyl n-(2-hydroxyethyl)-carbamateethyl 2-hydroxy-ethylcarbamateethyl(2-hydroxyethyl)carbamateNSC118052-hydroxyethyl urethaneethyl 2-hyroxyethylcarbamateNCIOpen2_000058

Weitere Namen anzeigen

Ethyl(2-Hydroxy ethyl)carbamateN-(2-hydroxyethyl)carbamic acid ethyl ester(2-HYDROXY-ETHYL)-CARBAMIC ACID ETHYL ESTERCarbamic acid, N-(2-hydroxyethyl)-, ethyl ester

ethyl 2-hydroxyethylcarbamateSCHEMBL499385SCHEMBL499386SCHEMBL1416053SCHEMBL1416054DTXSID20971405IDWDPUULTDNNBY-UHFFFAOYSA-NFAA60293

Datenbank-Bezeichner

CAS: 5602-93-7
PubChem CID: 223805
DTXSID: DTXSID20971405
EC Number: 690-609-3
Nikkaji: J1.485.671D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,4
Polarare Oberfläche (TPSA): 58,6 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 4
Schwere Atome: 9
Formalladung: 0
Komplexität: 84

Physikochemische Eigenschaften

Schmelzpunkt: 87 °C · 87 °C
Siedepunkt: 112 · 112-114 °C(Press: 0.6 Torr)
Dichte: 1.101 · 1.101±0.06 g/cm3(Predicted)
pka: 11.99 · 11.99±0.46(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 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.