N-tert-Butyl-N'-propyl ethylenediamine
Basic information
- CAS
886500-79-4- Standard SMILES
CCCNCCNC(C)(C)C- InChIKey
WLPURHCGIKOTDU-UHFFFAOYSA-N- Molecular formula
- C9H22N2
- Average molar mass
- 158.28 g/mol
- Monoisotopic mass
- 158.17829871
Names & identifiers
- Preferred name
- N-tert-Butyl-N'-propyl ethylenediamine
- IUPAC
- N'-tert-butyl-N-propylethane-1,2-diamine
- English name
- N-tert-Butyl-N'-propyl ethylenediamine
- Molecular formula
- C9H22N2
- Molecular weight
- 158.28
Names & synonyms
N-tert-Butyl-N'-propyl ethylenediamine886500-79-4N'-tert-butyl-N-propylethane-1,2-diamineSCHEMBL19599273DTXSID00428260N-tert-Butyl-N'-propylethylenediamineAKOS005306408N~1~-tert-Butyl-N~2~-propylethane-1,2-diamine1,2-Ethanediamine, N1-(1,1-dimethylethyl)-N2-propyl-N-tert-Butyl-N′-propyl ethylenediamine, CAS 886500-79-4
Database identifiers
- CAS
886500-79-4- PubChem CID
- 7171998
- DTXSID
DTXSID00428260
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 84.1
Physicochemical properties
- Symbol(GHS)
- 5 · GHS05,GHS07
- RIDADR
- 1760 · UN1760
- HazardClass
- 8 · 8
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
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
- UN1760
- Symbol(GHS)
- GHS05,GHS07
- hazard_class
- 8
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid) or 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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