3-cyclopropyl-1-methyl-1H-pyrazol-5-amine

HCID 2735311

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Grundinformationen

CAS: 118430-74-3
Standard-SMILES: Cn1nc(C2CC2)cc1N
InChIKey: YWHWPIRLFHZSFS-UHFFFAOYSA-N
Summenformel: C7H11N3
Durchschnittliche Molmasse: 137,18 g/mol
Monoisotopische Masse: 137,09529736

Namen und Bezeichner

Bevorzugter Name: 3-cyclopropyl-1-methyl-1H-pyrazol-5-amine
IUPAC: 3-cyclopropyl-1-methylpyrazol-5-amine
Englischer Name: 3-CYCLOPROPYL-1-METHYL-1H-PYRAZOL-5-AMINE
Summenformel: C7H11N3
Molmasse: 137.18

Namen und Synonyme

3-cyclopropyl-1-methyl-1H-pyrazol-5-amine118430-74-3DTXSID40370673RefChem:278846DTXCID00321707672-787-45-cyclopropyl-2-methylpyrazol-3-amineMFCD000679841H-Pyrazol-5-amine, 3-cyclopropyl-1-methyl-5-Amino-3-cyclopropyl-1-methylpyrazole5-amino-3-cyclopropyl-1-methyl-1h-pyrazole3-cyclopropyl-1-methylpyrazole-5-ylamine

Weitere Namen anzeigen

3-Cyclopropyl-1-methyl-1H-pyrazole-5-amine

SCHEMBL574082TIMTEC-BB SBB005491AKOS B024541BUTTPARK 47\08-28YWHWPIRLFHZSFS-UHFFFAOYSA-NART-CHEM-BB B024541TEA43074SBB005491

Datenbank-Bezeichner

CAS: 118430-74-3
PubChem CID: 2735311
DTXSID: DTXSID40370673
EC Number: 672-787-4
Nikkaji: J764.554F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,5
Polarare Oberfläche (TPSA): 43,8 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 1
Schwere Atome: 10
Formalladung: 0
Komplexität: 133

Physikochemische Eigenschaften

Schmelzpunkt: 123 · 123-126°C
Siedepunkt: 299.2 · 299.2±28.0 °C(Predicted)
Dichte: 1.37 · 1.37±0.1 g/cm3(Predicted)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka: 4.58 · 4.58±0.10(Predicted)
Aggregatzustand: crystalline solid
Farbe: Light orange
CAS Datenbank: 118430 · 118430-74-3(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；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, 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.