Grundinformationen
- Standard-SMILES
NCCCCO- InChIKey
BLFRQYKZFKYQLO-UHFFFAOYSA-N- Summenformel
- C4H11NO
- Durchschnittliche Molmasse
- 89,14 g/mol
- Monoisotopische Masse
- 89,08406397
Überblick
structure given in first source
Namen und Bezeichner
- Bevorzugter Name
- 4-Amino-1-butanol
- IUPAC
- 4-aminobutan-1-ol
- Lokaler Name
- 4-Amino-1-butanol
- Englischer Name
- 4-Amino-1-butanol
- Summenformel
- C4H11NO
- Molmasse
- 89.14
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
13325-10-5- PubChem CID
- 25868
- DTXSID
DTXSID70158027- EC Number
- 236-364-4
- Nikkaji
- J50.239A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -1,1
- Polarare Oberfläche (TPSA)
- 46,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 6
- Formalladung
- 0
- Komplexität
- 23,5
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 16 · 16-18 °C (lit.)
- Siedepunkt
- 206 °C · 206 °C (lit.)
- Dichte
- 0.967 g/mL · 0.967 g/mL at 25 °C (lit.)
- Brechungsindex
- 20 · n20/D ~1.462(lit.)
- Flammpunkt
- 226 °F · 226 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- Acetonitrile (Slightly), Chloroform (Sparingly), Methanol (Slightly)
- Aggregatzustand
- Liquid
- pka
- 15.1 · 15.10±0.10(Predicted)
- Farbe
- Clear colorless to slightly yellow
- Wasserlöslichkeit
- MISCIBLE
- BRN
- 1731411 · 1731411
- Stabilität
- Unstable in Aqueous Solution
- InChI
- 1S/C4H11NO/c5-3-1-2-4-6/h6H,1-5H2
- InChIKey
- BLFRQYKZFKYQLO-UHFFFAOYSA-N
- SMILES
- NCCCCO
- CAS Datenbank
- 13325 · 13325-10-5(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · NH2(CH2)4OH(13325-10-5)
- EPA chemische Informationen
- 1 · 1-Butanol, 4-amino- (13325-10-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (12.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 63 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Sicherheitsdaten
- F
- 34
- wgk
- 3
- ridadr
- UN 2735 8/PG 3
- hs_code
- 29221980
- risk_code
- 34-22
- hazard_code
- C
- safety_code
- 26-36/37/39-45-25
- hazard_class
- 8
- packing_group
- III
- Speicherklasse
- 8A - Combustible corrosive hazardous materials
- Hazard Classifications
- Eye Dam. 1Skin Corr. 1B
Chemie und Industrie
Anwendungen
Beschreibung4-Amino-1-butanol (4AB) is an important pharmaceutical intermediate compound and a precursor of biodegradable polymers for gene delivery. It can be used in organic synthesis and biological properties studies, among others. In addition, 4-Amino-1-butanol (4AB) has been shown to have a higher CO2 solubility than 2-amino-1-ethanol (MEA), which is potentially useful in solving problems related to flue gas purification[1-2].
Verwenden4-Amino-1-butanol is a useful intermediate in a variety of organic synthesis. It is mainly used in personal-care products, preparation of water soluble cationic flocculants and ion exchange resins as well as in the preparation of beta-lactam antibiotics. It is used for the production of efficient anionic emulsifiers, nonionic polyethylene emulsions, water treatment, metal treatment and absorption of carbon dioxide gas. It is used as a pigment dispersion aid and curing agent in selected textile -resins.
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