Dimethyl N-(tert-Butoxycarbonyl)-L-glutamate
Grundinformationen
- CAS
59279-60-6- Standard-SMILES
COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)OC- InChIKey
QNSPKWUAZQIIGZ-QMMMGPOBSA-N- Summenformel
- C12H21NO6
- Durchschnittliche Molmasse
- 275,3 g/mol
- Monoisotopische Masse
- 275,13688739
Namen und Bezeichner
- Bevorzugter Name
- Dimethyl N-(tert-Butoxycarbonyl)-L-glutamate
- IUPAC
- dimethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate
- Englischer Name
- (R)-N-Boc-glutamic acid-1,5-dimethyl ester
- Summenformel
- C12H21NO6
- Molmasse
- 275.3
Namen und Synonyme
59279-60-6dimethyl N-(tert-butoxycarbonyl)-L-glutamateDTXSID403704161,5-Dimethyl N-((1,1-dimethylethoxy)carbonyl)-L-glutamate1,5-Dimethyl N-[(1,1-dimethylethoxy)carbonyl]-L-glutamateRefChem:588290DTXCID70321451858-937-3Boc-Glu(OMe)-OMeN-Boc-L-Glutamic Acid dimethyl ester(S)-Dimethyl 2-((tert-butoxycarbonyl)amino)pentanedioate(R)-N-Boc-glutamic acid-1,5-dimethyl ester
Weitere Namen anzeigen
BOC-GLU(OME)-OME 45GBOC-L-GLUTAMIC ACID DIMETHYL ESTERdimethyl(tert-butoxycarbonyl)-L-glutamate(S)-diMethyl 2-(tert-butoxycarbonylaMino)pentanedioateBOC-L-GLU(ME)-OME
dimethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioateMFCD03094774N-Boc-L-glutamic acid 1,5-dimethyl esterBoc-L-Glu(Ome)-OmeDimethyl (tert-butoxycarbonyl)-L-glutamatedimethyl (2S)-2-(tert-butoxycarbonylamino)pentanedioateDS-14363N-alpha-t-Butyloxycarbonyl-L-glutamic acid dimethyl diester
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,1
- Polarare Oberfläche (TPSA)
- 90,9 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 9
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 334
Physikochemische Eigenschaften
- Schmelzpunkt
- 43 to · 43.0 to 47.0 °C
- Siedepunkt
- 370.9 · 370.9±32.0 °C(Predicted)
- Dichte
- 1.117 · 1.117±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly)
- pka
- 10.86 · 10.86±0.46(Predicted)
- Aggregatzustand
- Liquid
- Farbe
- Colorless to pale yellow
- InChI
- InChI=1S/C12H21NO6/c1-12(2,3)19-11(16)13-8(10(15)18-5)6-7-9(14)17-4/h8H,6-7H2,1-5H3,(H,13,16)/t8-/m0/s1
- InChIKey
- QNSPKWUAZQIIGZ-QMMMGPOBSA-N
- SMILES
- C(OC)(=O)[C@H](CCC(OC)=O)NC(OC(C)(C)C)=O
- CAS Datenbank
- 59279 · 59279-60-6(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
Warning
H315 (33.3%): Causes skin irritation [Warning Skin corrosion/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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationStatus: Active Update: 15-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/33073
Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)
Sicherheitsdaten
- hs_code
- 2922420090
Chemie und Industrie
Anwendungen
Verwenden(R)-N-Boc-glutamic acid-1,5-dimethyl ester can be used as organic synthesis intermediates and pharmaceutical intermediates, mainly used in laboratory research and development and chemical production processes.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter100 Anbieter
北京华美互利生物化工010-56205725 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
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