N,N'-Bis(2-pentyl)-ethylenediamine
Basic information
- CAS
88829-02-1- Standard SMILES
CCCC(C)NCCNC(C)CCC- InChIKey
MEDKKMLZDPVMCW-UHFFFAOYSA-N- Molecular formula
- C12H28N2
- Average molar mass
- 200.36 g/mol
- Monoisotopic mass
- 200.2252489
Names & identifiers
- Preferred name
- N,N'-Bis(2-pentyl)-ethylenediamine
- IUPAC
- N,N'-di(pentan-2-yl)ethane-1,2-diamine
Names & synonyms
N,N'-Bis(2-pentyl)-ethylenediamine88829-02-1Ethylenediamine, N,N'-bis(1-methylbutyl)-N,N'-bis(1-methylbutyl)ethane-1,2-diamineSCHEMBL31008624DTXSID901008503N,N'-Bis(2-pentyl)ethylenediamineN~1~,N~2~-Di(pentan-2-yl)ethane-1,2-diamine
Database identifiers
- CAS
88829-02-1- PubChem CID
- 42677
- DTXSID
DTXSID901008503
Properties
Computed structural properties
- XLogP
- 2.7
- 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
- 101
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Compound notes
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