Grundinformationen
- Standard-SMILES
NCC1CCOC1- InChIKey
CINJIXGRSTYIHP-UHFFFAOYSA-N- Summenformel
- C5H11NO
- Durchschnittliche Molmasse
- 101,15 g/mol
- Monoisotopische Masse
- 101,08406397
Namen und Bezeichner
- Bevorzugter Name
- (Tetrahydrofuran-3-yl)methanamine
- IUPAC
- oxolan-3-ylmethanamine
- Englischer Name
- Tetrahydrofuran-3-yl)methanamine
- Summenformel
- C5H11NO
- Molmasse
- 101.15
Namen und Synonyme
(tetrahydrofuran-3-yl)methanamineDTXSID30447520RefChem:408477DTXCID30398341165253-31-6Oxolan-3-ylmethanamine3-furanmethanamine, tetrahydro-1-tetrahydrofuran-3-ylmethanamine3-(Aminomethyl)tetrahydrofuranc-(tetrahydro-furan-3-yl)-methylamineTETRAHYDRO-3-FURANMETHANAMINEMFCD08234925
Weitere Namen anzeigen
3-Aminomethyltetrahydrofuran3-Aminomethyl-THFoxolan-3-ylmethylamine3-Tetrahydro-furanmethanamine3-FuranMethanaMine,tetrahydro-(Tetrahydrofur-3-yl)methylamine
tetrahydrofuran-3-ylmethylamineC-(Tetrahydrofuran-3-yl)methylamine(oxolan-3-yl)methanamine(tetrahydrofuran-3-yl)methylamine(R)-Tetrahydrofuran-3-methanamine(S)-Tetrahydrofuran-3-methanamine[(3R)-Tetrahydrofuran-3-yl]methanamine1-(OXOLAN-3-YL)METHANAMINE
Datenbank-Bezeichner
- CAS
165253-31-6- PubChem CID
- 10898660
- DTXSID
DTXSID30447520- Nikkaji
- J1.801.509I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,5
- Polarare Oberfläche (TPSA)
- 35,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 56
Physikochemische Eigenschaften
- Siedepunkt
- 156 · 156.0±13.0℃ (760 Torr)
- Dichte
- 0.967 · 0.967±0.06 g/cm3 (20 ºC 760 Torr)
- Brechungsindex
- 20 · n20/D1.462
- Flammpunkt
- 53.1 · 53.1±13.1℃
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solution
- pka
- 9.96 · 9.96±0.29(Predicted)
- Farbe
- Clear colorless
- InChI
- InChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2
- InChIKey
- CINJIXGRSTYIHP-UHFFFAOYSA-N
- SMILES
- O1CCC(CN)C1
- CAS Datenbank
- 165253 · 165253-31-6
Sicherheit und Regulatorisches
Sicherheitsdaten
- wgk
- 3
- ridadr
- 1993
- hs_code
- 29321900
- risk_code
- 10-37/38-41
- hazard_code
- Xi
- safety_code
- 26-37/39
- hazard_class
- 3
- packing_group
- Ⅲ
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Eye Dam. 1Flam. Liq. 3Skin Irrit. 2STOT SE 3
Chemie und Industrie
Anwendungen
VerwendenTetrahydrofuran-3-yl)methanamine is an intermediate in the synthesis of Dinoteturan(D482100), a neonicotinoid insecticide.
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