2-Pentanamine

HCID 12246CAS 41444-43-3

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CCCC(C)N
InChIKey: IGEIPFLJVCPEKU-UHFFFAOYSA-N
Summenformel: C5H13N
Durchschnittliche Molmasse: 87,16 g/mol
Monoisotopische Masse: 87,10479942

Namen und Bezeichner

Bevorzugter Name: 2-Pentanamine
IUPAC: pentan-2-amine
Englischer Name: 2-AMINOPENTANE
Summenformel: C5H13N
Molmasse: 87.16

Namen und Synonyme

63493-28-72-Pentylamine2-Pentanamine1-METHYLBUTYLAMINEsec-Amylamine1-Methyl-n-butylamineButylamine, 1-methyl-DL-2-AminopentaneMethylpropylcarbinylamineNSC 6367QH0285API3NSC-6367

Weitere Namen anzeigen

2-Methylbutylamine2-AMYLAMINE2-AMINOPENTANEsec-pentylamine2-Aminopentane>2-AMINOPENTANE HCL(+/-)-2-pentanamin

(1)-1-MethylbutylamineEINECS 210-886-2EINECS 264-269-8DTXSID50870715RefChem:477803Butylamine, 1-methyl-(8CI)DTXCID10818411210-886-2

Datenbank-Bezeichner

CAS: 41444-43-3、625-30-9、63493-28-7
PubChem CID: 12246
DTXSID: DTXSID50870715
UNII: QH0285API3
EC Number: 210-886-2、255-366-6、264-269-8
Nikkaji: J129.194G

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 26 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 6
Formalladung: 0
Komplexität: 27

Physikochemische Eigenschaften

Schmelzpunkt: 32 · 32-34 °C
Siedepunkt: 90.5 · 90.5-91.5 °C (lit.)
Dichte: 0.736 g/mL · 0.736 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.4020(lit.)
Flammpunkt: 95 °F · 95 °F
storage temp.: 2 · 2-8°C
pka: 11.04 · 11.04±0.35(Predicted)
Aggregatzustand: clear liquid
Farbe: Colorless to Light yellow to Light orange
JECFA Number: 1586 · 1586
BRN: 635657 · 635657
InChI: 1S/C5H13N/c1-3-4-5(2)6/h5H,3-4,6H2,1-2H3
InChIKey: IGEIPFLJVCPEKU-UHFFFAOYSA-N
SMILES: CCCC(C)N
LogP: 1.41 · 1.410 (est)
CAS Datenbank: 63493 · 63493-28-7(CAS DataBase Reference)
EPA chemische Informationen: 2 · 2-Pentanamine (63493-28-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 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.