Basic information
- CAS
41340-88-9- Standard SMILES
O=C(N1CCCCC1)N1CCNCC1- InChIKey
KYEVTVIFIFPALW-UHFFFAOYSA-N- Molecular formula
- C10H19N3O
- Average molar mass
- 197.28 g/mol
- Monoisotopic mass
- 197.15281223
Names & identifiers
- Preferred name
- 1-(1-Piperidinylcarbonyl)piperazine
- IUPAC
- piperazin-1-yl(piperidin-1-yl)methanone
- English name
- Piperazin-1-yl-piperidin-1-yl-methanone
- Molecular formula
- C10H19N3O
- Molecular weight
- 197.28
Names & synonyms
1-(1-piperidinylcarbonyl)piperazineRefChem:419969664-211-541340-88-9Piperazin-1-yl-piperidin-1-yl-methanonepiperazin-1-yl(piperidin-1-yl)methanone1-(piperidin-1-ylcarbonyl)piperazine1-(piperidine-1-carbonyl)piperazineMFCD03844723piperazinyl piperidyl ketoneSCHEMBL3031399SCHEMBL3175235
Show more names
AKOS BBS-00005891Piperazin-1-yl-piperidin-1-yl-methaMethanone, 1-piperazinyl-1-piperidinyl-1-piperazinyl(1-piperidinyl)methanone hydrochloride
1-(piperidinocarbonyl)piperazineDTXSID00360257KYEVTVIFIFPALW-UHFFFAOYSA-NSBB042062piperazin-1-yl(1-piperidyl)methanonepiperazin-1-ylpiperidin-1-ylmethanoneAKOS000263531BS-12092
Database identifiers
- CAS
41340-88-9- PubChem CID
- 1095015
- DTXSID
DTXSID00360257- EC Number
- 664-211-5
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 35.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Melting point
- 80 · 80-82°C
- Boiling point
- 314.4 · 314.4±35.0 °C(Predicted)
- Density
- 1.106 · 1.106±0.06 g/cm3(Predicted)
- pka
- 8.77 · 8.77±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (97.4%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (97.4%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H315-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
7 records
Compound notes
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