Basic information
- CAS
71550-54-4- Standard SMILES
CCCOc1cc(N2CCCC2)c(OCCC)cc1N- InChIKey
GVIVGDWHPMPUGY-UHFFFAOYSA-N- Molecular formula
- C16H26N2O2
- Average molar mass
- 278.39 g/mol
- Monoisotopic mass
- 278.19942808
Names & identifiers
- Preferred name
- Benzenamine, 2,5-dipropoxy-4-(1-pyrrolidinyl)-
- IUPAC
- 2,5-dipropoxy-4-pyrrolidin-1-ylaniline
- English name
- 2,5-Dipropoxy-4-(1-pyrrolidinyl)benzenamine
- Molecular formula
- C16H26N2O2
- Molecular weight
- 278.39
Names & synonyms
Benzenamine, 2,5-dipropoxy-4-(1-pyrrolidinyl)-71550-54-4DTXSID2072380RefChem:561658DTXCID80470582,5-DIPROPOXY-4-(PYRROLIDIN-1-YL)ANILINEGVIVGDWHPMPUGY-UHFFFAOYSA-N2,5-Dipropoxy-4-(1-pyrrolidinyl)benzenamine
Database identifiers
- CAS
71550-54-4- PubChem CID
- 3085508
- DTXSID
DTXSID2072380- Nikkaji
- J446.853H
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 47.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 269
Physicochemical properties
- Boiling point
- 457.9 · 457.9±45.0 °C(Predicted)
- Density
- 1.069 · 1.069±0.06 g/cm3(Predicted)
- pka
- 7.71 · 7.71±0.40(Predicted)
- EPA Substance Registry System
- 2 · Benzenamine, 2,5-dipropoxy-4-(1-pyrrolidinyl)- (71550-54-4)
- 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 InformationBenzenamine, 2,5-dipropoxy-4-(1-pyrrolidinyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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