4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine

HCID 25658249CAS 297172-18-0
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Grundinformationen

Standard-SMILES
Cn1cnnc1C1CCNCC1
InChIKey
LBGLYAJNIDZGGO-UHFFFAOYSA-N
Summenformel
C8H14N4
Durchschnittliche Molmasse
166,22 g/mol
Monoisotopische Masse
166,12184646

Namen und Bezeichner

Bevorzugter Name
4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine
IUPAC
4-(4-methyl-1,2,4-triazol-3-yl)piperidine
Englischer Name
5-(Piperidin-4-yl)-4-methyl-4H-1,2,4-triazole
Summenformel
C8H14N4
Molmasse
166.22

Namen und Synonyme

297172-18-04-(4-methyl-4H-1,2,4-triazol-3-yl)piperidineDTXSID80649734RefChem:288138DTXCID606004844-(4-methyl-1,2,4-triazol-3-yl)piperidineMFCD09055373Piperidine, 4-(4-methyl-4H-1,2,4-triazol-3-yl)-4-(4-methyl-4H-[1,2,4]triazol-3-yl)-piperidine4-(4-Methyl-4H-124-triazol-3-yl)piperidineSCHEMBL239491SCHEMBL4013880
Weitere Namen anzeigen
4-(4-Methyl-4H-1,2,4-triazol-3-yl)4-(4-Methyl-1,2,4-triazol-3-yl)piperidi5-(Piperidin-4-yl)-4-methyl-4H-1,2,4-triazole4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidine HBr4-(4-methyl-4H-1,2,4-triazol-3-yl)piperidine(SALTDATA: 2HCl H2O)4-(4-Methyl-4H-1,2,4-triazol-3-yl)piperidine Dihydrochloride Hydrate
LBGLYAJNIDZGGO-UHFFFAOYSA-NAKOS009186576CCG-211294SB41441DS-14014SY101592EN300-31837C74525

Datenbank-Bezeichner

CAS
297172-18-0
PubChem CID
25658249
DTXSID
DTXSID80649734
EC Number
857-158-6

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-0,4
Polarare Oberfläche (TPSA)
42,7 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
1
Schwere Atome
12

Physikochemische Eigenschaften

Siedepunkt
331 · 331.0±52.0 °C(Predicted)
Dichte
1.29 · 1.29±0.1 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
9.84 · 9.84±0.10(Predicted)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, 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 CategoriesAcute Tox. 4 (50%)；Skin Irrit. 2 (100%)；Eye Dam. 1 (50%)；STOT SE 3 (100%)

Sicherheitsdaten

hs_code
2933998090

Chemie und Industrie

Anbieter40 Anbieter

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

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