Basic information
- CAS
16675-58-4- Standard SMILES
C1=C(N2CCCC2)CCN(Cc2ccccc2)C1- InChIKey
FZDVISZQJCGYCD-UHFFFAOYSA-N- Molecular formula
- C16H22N2
- Average molar mass
- 242.36 g/mol
Names & identifiers
- Preferred name
- 1-Benzyl-4-(1-pyrrolidinyl)-1,2,3,6-tetrahydropyridine
- IUPAC
- 1-benzyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine
- English name
- 1-benzyl-4-(pyrrolidin-1-yl)-1,2,3,6-tetrahydropyridine
- Molecular formula
- C16H22N2
- Molecular weight
- 242.36
Names & synonyms
1-Benzyl-4-(1-pyrrolidinyl)-1,2,3,6-tetrahydropyridine16675-58-4SCHEMBL10173571-benzyl-4-(pyrrolidin-1-yl)-1,2,3,6-tetrahydropyridineFZDVISZQJCGYCD-UHFFFAOYSA-NDA-297961-Benzyl-4-pyrrolidino-1,2,5,6-tetrahydropyridine1-benzyl-4-pyrrolidin-1-yl-1,2,3,6-tetrahydropyridine1-Benzyl-4-(1-pyrrolidinyl)-1,2, 3,6-tetrahydropyridine1-benzyl-1,2,3,6-tetrahydro-4-(pyrrolidin-1-yl)pyridinePyridine, 1,2,3,6-tetrahydro-1-(phenylmethyl)-4-(1-pyrrolidinyl)-
Database identifiers
- CAS
16675-58-4- Nikkaji
- J1.083.633F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 285
Physicochemical properties
- Boiling point
- 372.7 · 372.7±31.0 °C(Predicted)
- Density
- 1.098 · 1.098±0.06 g/cm3(Predicted)
- pka
- 7.77 · 7.77±0.20(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers2 total
上海堃睿化工科技有限公司+86-021-50935922
四川伊诺唯新生物医药有限公司13880361484 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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