(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine

HCID 688213
NotizenReaktionen
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

CAS
131864-67-0
Standard-SMILES
CC(C)[C@@H]1COC(c2cccc(C3=N[C@H](C(C)C)CO3)n2)=N1
InChIKey
CSGQGLBCAHGJDR-GJZGRUSLSA-N
Summenformel
C17H23N3O2
Durchschnittliche Molmasse
301,4 g/mol
Monoisotopische Masse
301,17902698

Namen und Bezeichner

Bevorzugter Name
(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine
IUPAC
(4R)-4-propan-2-yl-2-[6-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]-2-pyridinyl]-4,5-dihydro-1,3-oxazole
Englischer Name
(R,R)-2,2'-(2,6-Pyridinediyl)bis(4-isopropyl-2-oxazoline)
Summenformel
C17H23N3O2
Molmasse
301.38

Namen und Synonyme

(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridineDTXSID40350834RefChem:407488DTXCID80301901624-758-2131864-67-02,6-bis((R)-4-isopropyl-4,5-dihydrooxazol-2-yl)pyridine(R,R)-i-Pr-pybox2,6-Bis[(4R)-(+)-isopropyl-2-oxazolin-2-yl]pyridinei-Pr-pybox, (R,R)-MFCD01321334(R,R)Isopropyl-pybox
Weitere Namen anzeigen
(R,R)-iPr-Pybox2,6-bis((4R)-(+)-isopropyl-2-oxazolin-2-yl)pyridi2,6-Bis[(4R)-4-isopropyl-2-oxazolin-2-yl]pyridine(R,R)-2,2'-(2,6-PYRIDINEDIYL)BIS(4-ISOPROPYL-2-OXAZOL(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine >(+)-2,6-Bis[(4R)-4-(i-propyl)-2-oxazolin-2-yl]pyridine2,6-Bis[(4R)-(+)-isopropyl-2-oxazolin-2-yl]pyridine 99%
UNII-7JMD4LB64Z(R,R)-i-Pr-pybox [MI]i-Pr-pybox, (R,R)-(+)-Pyridine, 2,6-bis[(4R)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-(4R)-4-propan-2-yl-2-[6-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole(R,R)-2,2'-(2,6-Pyridinediyl)bis(4-isopropyl-2-oxazoline)7JMD4LB64Z2,6-Bis((4R)-4-isopropyl-2-oxazolin-2-yl)pyridine

Datenbank-Bezeichner

CAS
131864-67-0
PubChem CID
688213
DTXSID
DTXSID40350834
ChEMBL
CHEMBL1906514
UNII
7JMD4LB64Z
EC Number
624-758-2
Nikkaji
J1.223.205E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,3
Polarare Oberfläche (TPSA)
56,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
4
Schwere Atome
22

Physikochemische Eigenschaften

Schmelzpunkt
154 · 154-156 °C(lit.)
Siedepunkt
457.1 · 457.1±30.0 °C(Predicted)
Dichte
1.23 · 1.23±0.1 g/cm3(Predicted)
Brechungsindex
118 ° · 118 ° (C=1, CH2Cl2)
storage temp.
Inert atmosphere,Room Temperature
Aggregatzustand
crystal

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 (97.5%): 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 40 reports by companies from 3 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. 2 (100%)；STOT SE 3 (97.5%)

Sicherheitsdaten

wgk
3
hs_code
29349990
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
hazard_class
IRRITANT

Chemie und Industrie

Anwendungen

VerwendenC2 symmetric ligand for enantioselective catalysis. Easily forms bidentate coordination complexes due to the strong affinity of the oxazoline nitrogen for various metals.

Anbieter100 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
陕西科贝莱药物研发有限公司13119135307 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

Zugehörige Reaktionen

101
Reaktionsaufzeichnung erstellen

Notizen zur Verbindung

Wird geladen…