Basic information
- CAS
170508-04-0- Standard SMILES
O=C(O)CN1CCC(N2CCCCC2)CC1- InChIKey
AEYVYPHDYRTLGS-UHFFFAOYSA-N- Molecular formula
- C12H22N2O2
- Average molar mass
- 226.32 g/mol
Names & identifiers
- Preferred name
- [1,4'-Bipiperidine]-1'-acetic acid
- IUPAC
- 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid
- English name
- [1,4'-Bipiperidine]-1'-acetic acid
- Molecular formula
- C12H22N2O2
- Molecular weight
- 226.32
Names & synonyms
170508-04-0[1,4'-Bipiperidine]-1'-acetic acid2-([1,4'-Bipiperidin]-1'-yl)acetic acid2-(4-piperidin-1-ylpiperidin-1-yl)acetic acidSCHEMBL4041964SCHEMBL28843101AKOS010494157[1,4']Bipiperidinyl-1'-yl-acetic acid2-([1,4'-Bipiperidin]-1'-yl)aceticacid2-{[1,4'-bipiperidine]-1'-yl}acetic acidF81253F1908-1263
Show more names
1,4'-BIPIPERIDINE]-1'-ACETIC ACID[1,4]Bipiperidinyl-1-yl-acetic acid2-{[1,4-bipiperidine]-1-yl}acetic acid
Database identifiers
- CAS
170508-04-0
Properties
Computed structural properties
- XLogP
- -1.9
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Physicochemical properties
- Boiling point
- 355.7 · 355.7±37.0 °C(Predicted)
- Density
- 1.126 · 1.126±0.06 g/cm3(Predicted)
- pka
- 2.47 · 2.47±0.10(Predicted)
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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