1-Isopropyl-2-methylpropylamin
3-Pentanamine, 2,4-dimethyl-
Grundinformationen
- CAS
4083-57-2- Standard-SMILES
CC(C)C(N)C(C)C- InChIKey
FATQVQVMXNESGD-UHFFFAOYSA-N- Summenformel
- C7H17N
- Durchschnittliche Molmasse
- 115,22 g/mol
- Monoisotopische Masse
- 115,13609954
Überblick
2,4-dimethylpentan-3-amine is a primary aliphatic amine that is pentan-3-amine substituted by methyl groups at positions 2 and 4. Metabolite observed in cancer metabolism. It has a role as a human metabolite.
Namen und Bezeichner
- Bevorzugter Name
- 3-Pentanamine, 2,4-dimethyl-
- IUPAC
- 2,4-dimethylpentan-3-amine
- Lokaler Name
- 1-Isopropyl-2-methylpropylamin
- Englischer Name
- 2,4-Dimethyl-3-pentylamine; >98%discontinued
- Summenformel
- C7H17N
- Molmasse
- 115.22
Namen und Synonyme
3-Pentanamine, 2,4-dimethyl-1-Isopropyl-2-methylpropylamine2,4-dimethyl-3-pentanamine2,4-DIMETHYL-3-PENTYLAMINEEINECS 223-809-2DTXSID0063288RefChem:504724DTXCID4039819223-809-22,4-dimethylpentan-3-amine4083-57-23-Amino-2,4-dimethylpentane
Weitere Namen anzeigen
>98%DISCONTINUED2,4-dimethyl-3-pentanamin2,4-Dimethylpentane-3-amine3-pentanamine,2,4-dimethyl-
(1-isopropyl-2-methylpropyl)amineMFCD000150412,4-dimethyl-3-aminopentane2,4-dimethylpent-3-ylamineSCHEMBL43238SCHEMBL1494093SCHEMBL2429976CHEBI:84245
Datenbank-Bezeichner
- CAS
4083-57-2- PubChem CID
- 77702
- DTXSID
DTXSID0063288- ChEBI
CHEBI:84245
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2
- Polarare Oberfläche (TPSA)
- 26 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 49,4
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesDensity
Physikochemische Eigenschaften
- Siedepunkt
- 125 · 125-127°
- Dichte
- 0.7882 · 0.7882
- EPA chemische Informationen
- 3 · 3-Pentanamine, 2,4-dimethyl- (4083-57-2)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
Danger
H225 (66.7%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information2,4-Dimethyl-3-pentylamine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesFlam. Liq. 2 (66.7%)
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 2924
- hazard_class
- 3.1
- packing_group
- II
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information3-Pentanamine, 2,4-dimethyl-: INACTIVE
Ergänzende Hinweise
DefinitionChEBI: A primary aliphatic amine that is pentan-3-amine substituted by methyl groups at positions 2 and 4. Metabolite observed in cancer metabolism.
Zugehörige Reaktionen
13
Notizen zur Verbindung
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