N-propylazepan-1-amine
Basic information
- CAS
3437-33-0- Standard SMILES
CCCNN1CCCCCC1- InChIKey
AOGPNSGQLBQHHH-UHFFFAOYSA-N- Molecular formula
- C9H20N2
- Average molar mass
- 156.27 g/mol
- Monoisotopic mass
- 156.16264865
Names & identifiers
- Preferred name
- N-propylazepan-1-amine
- IUPAC
- N-propylazepan-1-amine
- English name
- 3-Azepan-1-yl-propylamine
- Molecular formula
- C9H20N2
- Molecular weight
- 156.27
Names & synonyms
N-propylazepan-1-amineHEXAHYDRO-1H-AZEPINE-1-PROPANAMINEDTXSID10955911AKOS MSC-0395RARECHEM AL BW 2442ASINEX-REAG BAS 040854193-Azepan-1-yl-propylamine3-AZEPAN-1-YLPROPAN-1-AMINE3-(1-AZEPANYL)-1-PROPANAMINE3-(1-azepanyl)propan-1-amine1-(3-Amino-propyl)-homopiperidine3-HEXAMETHYLENEIMINO-1-PROPYLA MINE
Show more names
N-(3-aminopropyl)hexamethyleneimine
Database identifiers
- CAS
3437-33-0- PubChem CID
- 18920
- DTXSID
DTXSID10955911
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 85.6
Physicochemical properties
- Boiling point
- 70 · 70-72°C 0,5mm
- Density
- 0.9229 g/cm3 · 0.9229 g/cm3(Temp: 42 °C)
- storage temp.
- Refrigerator
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Oil
- pka
- 10.44 · 10.44±0.10(Predicted)
- color
- Colourless
- CAS DataBase Reference
- 3437 · 3437-33-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H413
- Precautionary statements
- 501 · P501-P273-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Hazard Codes
- Xi
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39
- RIDADR
- 2735 · 2735
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 2735
- hs_code
- 2933998090
- risk_code
- 34
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H413
- Precautionary statements
- P501-P273-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Applications
Uses3-(1-Azepanyl)-1-propanamine refinement of structural leads for centrally acting oxime reactivators of phosphylated cholinesterases.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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