1-Methyl-5-oxo-DL-prolin

1-methyl-5-oxo-DL-proline

HCID 13458634
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Grundinformationen

CAS
72442-37-6
Standard-SMILES
CN1C(=O)CCC1C(=O)O
InChIKey
SHLYZEAOVWVTSW-UHFFFAOYSA-N
Summenformel
C6H9NO3
Durchschnittliche Molmasse
143,14 g/mol
Monoisotopische Masse
143,05824315

Namen und Bezeichner

Bevorzugter Name
1-methyl-5-oxo-DL-proline
IUPAC
1-methyl-5-oxopyrrolidine-2-carboxylic acid
Lokaler Name
1-Methyl-5-oxo-DL-prolin
Englischer Name
1-methyl-5-oxo-DL-proline
Summenformel
C6H9NO3
Molmasse
143.14

Namen und Synonyme

72442-37-61-Methyl-5-oxo-DL-prolineEINECS 276-664-2RefChem:434476276-664-21-METHYL-5-OXOPYRROLIDINE-2-CARBOXYLIC ACID1-methyl-5-oxo-pyrrolidine-2-carboxylic acidMFCD157301501-METHYL-5-OXO-PROLINEN-methyl-2-pyrrolidone-5-carboxylic acidProline, 1-methyl-5-oxo-SCHEMBL159149
Weitere Namen anzeigen
1-methyl-5-oxypyrolidine-2-carboxylic acid1-methyl-5-oxo-pyrrolidine-2-carboxylic acid - [M87316]
N-Methyl-DL-pyroglutamic AcidSHLYZEAOVWVTSW-UHFFFAOYSA-NXCA44237AKOS012169845MB14791BS-17473DA-29149SY361897

Datenbank-Bezeichner

CAS
72442-37-6
PubChem CID
13458634
EC Number
276-664-2

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,6
Polarare Oberfläche (TPSA)
57,6 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
1
Schwere Atome
10

Physikochemische Eigenschaften

Schmelzpunkt
158 °C · 158 °C
Siedepunkt
361.7 · 361.7±35.0 °C(Predicted)
Dichte
1.319 · 1.319±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
3.53 · 3.53±0.20(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

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 2 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. 2A (100%)；STOT SE 3 (100%)

Sicherheitsdaten

Alarmwort
Warnung
Gefahrenhinweise
Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315

Chemie und Industrie

Anbieter21 Anbieter

上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
苏州奥佰医药科技有限公司1483287082 19962651230 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]

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