(+-)-1,4-Diazabicyclo[4.4.0]decane

HCID 2876391CAS 4430-75-5
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Grundinformationen

Standard-SMILES
C1CCN2CCNCC2C1
InChIKey
ONHPOXROAPYCGT-UHFFFAOYSA-N
Summenformel
C8H16N2
Durchschnittliche Molmasse
140,23 g/mol
Monoisotopische Masse
140,13134852

Namen und Bezeichner

Bevorzugter Name
(+-)-1,4-Diazabicyclo[4.4.0]decane
IUPAC
2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine
Englischer Name
Octahydro-2H-pyrido[1,2-a]pyrazine
Summenformel
C8H16N2
Molmasse
140.23

Namen und Synonyme

(+-)-1,4-Diazabicyclo(4.4.0)decane(+-)-1,4-Diazabicyclo[4.4.0]decaneRefChem:390809692-685-34430-75-5octahydro-1h-pyrido[1,2-a]pyrazineOctahydro-2H-pyrido[1,2-a]pyrazineOctahydro-pyrido[1,2-a]pyrazine1,4-diazabicyclo[4.4.0]decane2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazine(+/-)-1,4-Diazabicyclo[4.4.0]decaneMFCD01098257
Weitere Namen anzeigen
2-(4-fluorophenyl)-L-glycine1,4-Diazabicyclo[4.4.0]decane 97%2H-Pyrido[1,2-a]pyrazine, octahydro-(^+)-1,4-Diazabicyclo[4.4.0]decane,98+%(^+)-1,4-Diazabicyclo[4.4.0]decane, 98+%1,2,3,4,6,7,8,9-octahydropyrido[1,2-a]pyrazin-5-ium
CHEMBL98511Octahydropyrido[1,2-a]pyrazineoctahydro-1H-pyrido[1,2-a]piperazineSCHEMBL65291SCHEMBL174054SCHEMBL338531SCHEMBL338532(+/-)-1,4-diazabicyclo[

Datenbank-Bezeichner

CAS
4430-75-5
PubChem CID
2876391
DTXSID
DTXSID10386908
ChEMBL
CHEMBL98511
EC Number
692-685-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,5
Polarare Oberfläche (TPSA)
15,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
0
Schwere Atome
10

Physikochemische Eigenschaften

Siedepunkt
68 · 68-72℃/3mm
Dichte
1.01 · 1.01±0.1 g/cm3(Predicted)
storage temp.
2 · Storage temp. 2-8°C
Löslichkeit
Chloroform (Sparingly), Methanol (Slightly)
Aggregatzustand
Oil
pka
9.8 · 9.80±0.20(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, 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 Corr. 1B (50%)；Skin Irrit. 2 (50%)；Eye Irrit. 2 (50%)；STOT SE 3 (50%)

Sicherheitsdaten

ridadr
3267
hs_code
2902190000
hazard_class
8
packing_group
Ⅱ

Chemie und Industrie

Anbieter37 Anbieter

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Aladdin Scientific[email protected]

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