1,4-Benzenedimethanamine, N1,N1,N4,N4-tetraethyl-
Basic information
- CAS
40828-00-0- Standard SMILES
CCN(CC)Cc1ccc(CN(CC)CC)cc1- InChIKey
AALVUMWHVZETDU-UHFFFAOYSA-N- Molecular formula
- C16H28N2
- Average molar mass
- 248.41 g/mol
- Monoisotopic mass
- 248.2252489
Names & identifiers
- Preferred name
- 1,4-Benzenedimethanamine, N1,N1,N4,N4-tetraethyl-
- IUPAC
- N-[[4-(diethylaminomethyl)phenyl]methyl]-N-ethylethanamine
- English name
- N,N,N',N'-Tetraethyl-1,4-benzenedimethanamine
- Molecular formula
- C16H28N2
- Molecular weight
- 248.41
Names & synonyms
1,4-Benzenedimethanamine, N1,N1,N4,N4-tetraethyl-RefChem:4162761,4-Benzenedimethanamine, N,N,N',N'-tetraethyl-40828-00-0SCHEMBL7768079DTXSID8068256AALVUMWHVZETDU-UHFFFAOYSA-NN,N'-[1,4-Phenylenebis(methylene)]bis(N-ethylethan-1-amine)N,N,N',N'-Tetraethyl-1,4-benzenedimethanamine
Database identifiers
- CAS
40828-00-0- PubChem CID
- 3084802
- DTXSID
DTXSID8068256- Nikkaji
- J422.428K
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 308.1 · 308.1±22.0 °C(Predicted)
- Density
- 0.924 · 0.924±0.06 g/cm3(Predicted)
- pka
- 10.05 · 10.05±0.25(Predicted)
- EPA Substance Registry System
- 1 · 1,4-Benzenedimethanamine, N,N,N',N'-tetraethyl- (40828-00-0)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,4-Benzenedimethanamine, N1,N1,N4,N4-tetraethyl-: INACTIVE
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Related reactions
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Compound notes
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