Basic information
- CAS
4013-95-0- Standard SMILES
CCCCNCCNCCCC- InChIKey
YRGVKPIUZUOJSJ-UHFFFAOYSA-N- Molecular formula
- C10H24N2
- Average molar mass
- 172.31 g/mol
- Monoisotopic mass
- 172.19394877
Names & identifiers
- Preferred name
- N,N'-Dibutylethylenediamine
- IUPAC
- N,N'-dibutylethane-1,2-diamine
- English name
- N,N'-dibutylethylenediamine
- Molecular formula
- C10H24N2
- Molecular weight
- 172.31
Names & synonyms
1,2-Ethanediamine, N,N'-dibutyl-N,N'-Dibutylethylenediamine1,2-Ethanediamine, N1,N2-dibutyl-EINECS 223-667-1DTXSID7063263RefChem:160988DTXCID6039718223-667-1YRGVKPIUZUOJSJ-UHFFFAOYSA-N4013-95-0N,N'-dibutylethane-1,2-diamineN,N'-Di-n-butylethylenediamine
Show more names
butyl-[2-(butylamino)ethyl]amine
N1,N2-dibutylethane-1,2-diaminebutyl[2-(butylamino)ethyl]amineethane, 1,2-bisbutylamino-SCHEMBL341992SCHEMBL6181599N,N'-di(n-butyl)ethylenediamineN,N'-di-n-Butyl-ethylenediamineU922V759UH
Database identifiers
- CAS
4013-95-0- PubChem CID
- 77629
- DTXSID
DTXSID7063263- UNII
- U922V759UH
- EC Number
- 223-667-1
- Nikkaji
- J25.738I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 24.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 64.2
Physicochemical properties
- Boiling point
- 185 · 185-187 °C(Press: 3 Torr)
- Density
- 0.815 · 0.815±0.06 g/cm3(Predicted)
- pka
- 10.69 · 10.69±0.19(Predicted)
- EPA Substance Registry System
- 1 · 1,2-Ethanediamine, N,N'-dibutyl- (4013-95-0)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Ethanediamine, N1,N2-dibutyl-: INACTIVE
Applications
UsesN,N-Dibutylethane-1,2-diamine is a volatile flavor compound of semi-wild-blood Aba Tibetan pork.
Suppliers3 total
BOC Sciences+1-631-485-4226 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
3 records
Compound notes
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