Basic information
- CAS
57536-86-4- Standard SMILES
c1ccc2c(N3CCNCC3)cccc2c1- InChIKey
VNICFCQJUVFULD-UHFFFAOYSA-N- Molecular formula
- C14H16N2
- Average molar mass
- 212.29 g/mol
- Monoisotopic mass
- 212.13134851
Overview
1-(1-naphthalenyl)piperazine is a N-arylpiperazine.
Names & identifiers
- Preferred name
- 1-(1-Naphthyl)piperazine
- IUPAC
- 1-naphthalen-1-ylpiperazine
- English name
- 1-(1-Naphthyl)piperazine hydrochloride
- Molecular formula
- C14H16N2
- Molecular weight
- 212.29
Names & synonyms
1-(1-Naphthyl)piperazine57536-86-41-Naphthylpiperazine1-naphthalen-1-ylpiperazinePiperazine, 1-(1-naphthalenyl)-RefChem:739131-(naphthalen-1-yl)piperazineMFCD006000211-Naphthalen-1-yl-piperazineDTXSID30973071Lopac-S-003N-(1-naphthyl)piperazine
Show more names
NPPITIMTEC-BB SBB0031611-alpha-Naphthylpiperazine1-(1-NAPHTHYL)PIPERAZINE HCL1-(Napthalen-1-yl)Piperazine1-NAPHTHALENE-1-YL-PIPERAZINE HCL1-(1-Naphthyl)piperazine hydrochloride
Biomol-NT_0001001-NPN-(1- naphthyl)piperazineN-(1-naphthyl) piperazineSCHEMBL240244CHEMBL277120FJ7MR37A24PDSP1_000930
Database identifiers
- CAS
57536-86-4- PubChem CID
- 1342
- DTXSID
DTXSID30973071- ChEMBL
CHEMBL277120- ChEBI
CHEBI:108599- UNII
- FJ7MR37A24
- Nikkaji
- J387.179G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- Melting point
- 280 °C · 280°C (dec.)
- Boiling point
- 144 · 144-147 °C(Press: 1 Torr)
- Density
- 1.106 · 1.106
- solubility
- 2 O: · H2O: soluble
- pka
- 8.9 · 8.90±0.10(Predicted)
- form
- needles
- color
- white
- CAS DataBase Reference
- 57536 · 57536-86-4(CAS DataBase Reference)
- FDA UNII
- 7 MR37A24 · FJ7MR37A24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- WGK Germany
- 3 · 3
Safety & regulation
Safety data
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers26 total
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Additional notes
DefinitionChEBI: 1-(1-naphthalenyl)piperazine is a N-arylpiperazine.
Related reactions
72 records
Compound notes
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