Grundinformationen
- Standard-SMILES
O=[N+]([O-])c1ccc([C@H]2CO2)cc1- InChIKey
YKIUTLHCSNCTDZ-MRVPVSSYSA-N- Summenformel
- C8H7NO3
- Durchschnittliche Molmasse
- 165,15 g/mol
- Monoisotopische Masse
- 165,04259309
Namen und Bezeichner
- Bevorzugter Name
- (S)-2-(4-Nitrophenyl)oxirane
- IUPAC
- (2S)-2-(4-nitrophenyl)oxirane
- Englischer Name
- (S)-2-(4-Nitrophenyl)oxirane
- Summenformel
- C8H7NO3
- Molmasse
- 165.15
Namen und Synonyme
(S)-2-(4-Nitrophenyl)oxiraneRefChem:407873625-073-1(2S)-2-(4-NITROPHENYL)OXIRANE78038-42-3(S)-4-Nitrostyrene oxide(S)-PARA-NITROSTYRENE OXIDEOxirane, (4-nitrophenyl)-, (2S)-(S)-(4-Nitrophenyl)oxirane(R)-(4-Nitrophenyl)oxirane(S)-p-Nitrostyrene oxide(S)-para-nitro styrene oxide
Weitere Namen anzeigen
(2S)-2β-(4-Nitrophenyl)oxiraneOxirane, 2-(4-nitrophenyl)-, (2S)-
SCHEMBL1583098YKIUTLHCSNCTDZ-MRVPVSSYSA-NAKOS017390829DB04782DB-075402G81705EN300-1857252Q27095519
Datenbank-Bezeichner
- CAS
78038-42-3- PubChem CID
- 1237169
- EC Number
- 625-073-1
- Nikkaji
- J415.676E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,2
- Polarare Oberfläche (TPSA)
- 58,4 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 181
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.；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 CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- risk_code
- 22
- hazard_code
- Xn
Chemie und Industrie
Anwendungen
Verwenden(S)-(4-Nitrophenyl)oxirane is used as a reagent in the enantioconvergent synthesis of the β-blocker (R)-Nifenalol which is based on a combined chemoenzymic approach.
Anbieter4 Anbieter
西安华瑞致远生物科技有限公司18014474522 · [email protected]
南通敏言生物医药科技有限公司0513-85921823 18662920231 · [email protected]
南通普悦生物医药有限公司0513-0513-0513-89158300 18014392889 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Zugehörige Reaktionen
3
Verknüpfte Notizen
Wird geladen…