4,4'-(1,3-Dioxolane-2,2-diyl)dibutan-1-amine
Basic information
- CAS
40430-08-8- Standard SMILES
NCCCCC1(CCCCN)OCCO1- InChIKey
LHKGTEJKZQBSPP-UHFFFAOYSA-N- Molecular formula
- C11H24N2O2
- Average molar mass
- 216.32 g/mol
- Monoisotopic mass
- 216.18377801
Names & identifiers
- Preferred name
- 4,4'-(1,3-Dioxolane-2,2-diyl)dibutan-1-amine
- IUPAC
- 4-[2-(4-aminobutyl)-1,3-dioxolan-2-yl]butan-1-amine
Names & synonyms
40430-08-84,4'-(1,3-dioxolane-2,2-diyl)dibutan-1-amineNSC151984DTXSID50302586NSC-1519844,4'-(1,3-Dioxolane-2,2-diyl)di(butan-1-amine)
Database identifiers
- CAS
40430-08-8- PubChem CID
- 289746
- DTXSID
DTXSID50302586
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 147
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Compound notes
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