5-Aminopentan-1-ol

HCID 75634CAS 2508-29-4

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Grundinformationen

Standard-SMILES: NCCCCCO
InChIKey: LQGKDMHENBFVRC-UHFFFAOYSA-N
Summenformel: C5H13NO
Durchschnittliche Molmasse: 103,16 g/mol
Monoisotopische Masse: 103,09971404

Namen und Bezeichner

Bevorzugter Name: 5-Aminopentan-1-ol
IUPAC: 5-aminopentan-1-ol
Lokaler Name: 5-Aminopentan-1-ol
Englischer Name: 5-Amino-1-pentanol
Summenformel: C5H13NO
Molmasse: 103.16

Namen und Synonyme

5-Amino-1-pentanol5-Aminopentan-1-ol2508-29-4EINECS 219-718-2LQGKDMHENBFVRC-UHFFFAOYSA-DTXSID101797715Amino1pentanolRefChem:532445DTXCID70102262219-718-2InChI=1/C5H13NO/c6-4-2-1-3-5-7/h7H,1-6H21-Pentanol, 5-amino-

Weitere Namen anzeigen

NH2-PEN-OHH-APE(5)-OLPentanolamineNH2-(CH2)5-OHAminopentanol5-Amino-1-pen5-PENTANOLAMINE5-aminopentylol

MFCD00008237Pentanol, 5-amino-5-Amino-pentan-1-ol5-aminopentanolTolmetin ?-D-Glucuronidepentane, 1-amino-5-hydroxy-5-AMINO-1-PENTANOL, 50% in Water5-amino pentanol

Datenbank-Bezeichner

CAS: 2508-29-4
PubChem CID: 75634
DTXSID: DTXSID10179771
ChEMBL: CHEMBL333552
EC Number: 219-718-2
Nikkaji: J47.665J

Eigenschaften

Berechnete Struktureigenschaften

XLogP: -0,3
Polarare Oberfläche (TPSA): 46,3 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 7
Formalladung: 0
Komplexität: 31,3

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Amino Alcohols, Other

SpringerMaterials PropertiesOptical coefficient

Physical DescriptionWhite or pale yellow solid; mp = 34-37 deg C; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt: 33 · 33-35 °C (lit.)
Siedepunkt: 120 · 120-122 °C/16 mmHg (lit.)
Dichte: 0.949 g/mL · 0.949 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.4615(lit.)
Flammpunkt: 150 °F · 150 °F
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit: Chloroform, Ethyl Acetate
Aggregatzustand: Oil
pka: 15.16 · 15.16±0.10(Predicted)
Farbe: Yellow
PH: 13.2 · 13.2 (500g/l, H2O, 20℃)
Wasserlöslichkeit: miscible
BRN: 1732302 · 1732302
InChI: 1S/C5H13NO/c6-4-2-1-3-5-7/h7H,1-6H2
InChIKey: LQGKDMHENBFVRC-UHFFFAOYSA-N
SMILES: NCCCCCO
CAS Datenbank: 2508 · 2508-29-4(CAS DataBase Reference)
NIST chemische Informationen: 5 · Pentanol, 5-amino-(2508-29-4)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 0.7% (1 of 152) of reports.

Danger

H302 (98.7%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 152 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazards SummaryCauses burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; Harmful by ingestion; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 4 (98.7%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

Sicherheitsdaten

F: 10-34
wgk: 2
ridadr: UN 3259 8/PG 3
hs_code: 29221980
risk_code: 22-34-35
hazard_code: C
hazard_note: Irritant
safety_code: 26-36/37/39-45
hazard_class: 8
packing_group: III
Speicherklasse: 8A - Combustible corrosive hazardous materials
Hazard Classifications: Acute Tox. 4 OralSkin Corr. 1B

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden5-Amino-1-pentanol is an aliphatic amino alcohol with potential plasma lipid-lowering properties. 5-Amino-1-pentanol and other amino alcohols are used as emulsifying agents in dry-cleaning soaps, wax removers, cosmetics, paints and insecticides.