N,N'-Bis(3-pentyl)-ethylenediamine
Basic information
- CAS
88829-01-0- Standard SMILES
CCC(CC)NCCNC(CC)CC- InChIKey
WCZQQMYWEQYDLG-UHFFFAOYSA-N- Molecular formula
- C12H28N2
- Average molar mass
- 200.36 g/mol
- Monoisotopic mass
- 200.2252489
Names & identifiers
- Preferred name
- N,N'-Bis(3-pentyl)-ethylenediamine
- IUPAC
- N,N'-di(pentan-3-yl)ethane-1,2-diamine
Names & synonyms
N,N'-Bis(3-pentyl)-ethylenediamine88829-01-0Ethylenediamine, N,N'-bis(1-ethylpropyl)-n,n'-bis(1-ethylpropyl)ethane-1,2-diamine88618-92-2SCHEMBL12762826DTXSID20237351N,N'-Bis(3-pentyl)ethylenediamineN~1~,N~2~-Di(pentan-3-yl)ethane-1,2-diamine
Database identifiers
- CAS
88829-01-0- PubChem CID
- 469903
- DTXSID
DTXSID20237351
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 92.9
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