Grundinformationen
- CAS
2708-77-2- Standard-SMILES
NC(CC(F)C(=O)O)C(=O)O- InChIKey
JPSHPWJJSVEEAX-UHFFFAOYSA-N- Summenformel
- C5H8FNO4
- Durchschnittliche Molmasse
- 165,12 g/mol
- Monoisotopische Masse
- 165,0437359
Überblick
RN given refers to cpd without isomeric designation
Namen und Bezeichner
- Bevorzugter Name
- 4-Fluoroglutamic acid
- IUPAC
- 2-amino-4-fluoropentanedioic acid
- Lokaler Name
- 4-Fluorglutaminsure
- Englischer Name
- 4-Fluoro-DL-glutamic acid
- Summenformel
- C5H8FNO4
- Molmasse
- 165.12
Namen und Synonyme
2708-77-24-Fluoroglutamic acidgamma-fluoroglutamic acidRefChem:99020220-302-84-Fluoro-DL-glutamic acid2-amino-4-fluoropentanedioic acidDL-erythro-4-Fluoroglutamic acid2-AMINO-4-FLUORO-PENTANEDIOIC ACID91383-48-1L-erythro-4-Fluoroglutamic acidMFCD00055778
Weitere Namen anzeigen
H-4-F-DL-Glu-OHDL-4-FLUOROGLUTAMIC ACIDDL-4-Fluoroglutamicacid98%4-Fluoro-DL-glutamicacid98%DL-4-Fluoroglutamic acid 98%4-FLUORO-DL-GLUTAMIC ACID 97%4-Fluoro-DL-glutamic acid >=93%
Glutamic acid, 4-fluoro-C5H8FNO44- fluoroglutamateEINECS 220-302-8SCHEMBL502879CHEMBL53083772-amino-4-fluoropentanedioicacidDTXSID40949843
Datenbank-Bezeichner
- CAS
2708-77-2- PubChem CID
- 102871
- DTXSID
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -3
- Polarare Oberfläche (TPSA)
- 101 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 172
Physikochemische Eigenschaften
- Schmelzpunkt
- 185 °C · 185°C (dec.)
- Siedepunkt
- 342.4 · 342.4±42.0 °C(Predicted)
- Dichte
- 1.498 · 1.498±0.06 g/cm3(Predicted)
- pka
- 2.06 · 2.06±0.10(Predicted)
- Aggregatzustand
- solid
- Farbe
- White
- BRN
- 1947477 · 1947477
- Major Application
- peptide synthesis
- InChI
- 1S/C5H8FNO4/c6-2(4(8)9)1-3(7)5(10)11/h2-3H,1,7H2,(H,8,9)(H,10,11)
- InChIKey
- JPSHPWJJSVEEAX-UHFFFAOYSA-N
- SMILES
- NC(CC(F)C(O)=O)C(O)=O
- CAS Datenbank
- 2708 · 2708-77-2(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
Warning
H315 (97.5%): 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (97.5%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2922498590
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
- hazard_class
- IRRITANT
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
Verwenden4-Fluoro-DL-glutamic acid is used as a reagent to synthesize analogues of Methotrexate (M260675), a drug that is used to treat acute leukemia, breast carcinoma, and rheumatoid arthritis. The labelled form of 4-Fluoro-DL-glutamic acid is used in the medical field as an amino acid radiotracer for imaging of tumours.
Anbieter25 Anbieter
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
BOC Sciences16314854226 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
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