Basic information
- CAS
26103-49-1- Standard SMILES
O=S(=O)(c1cccnc1)N1CCCCC1- InChIKey
YVNUZIJEPPTRCL-UHFFFAOYSA-N- Molecular formula
- C10H14N2O2S
- Average molar mass
- 226.3 g/mol
- Monoisotopic mass
- 226.07759887
Names & identifiers
- Preferred name
- 3-(Piperidin-1-ylsulphonyl)pyridine
- IUPAC
- 3-piperidin-1-ylsulfonylpyridine
- English name
- 3-(Piperidin-1-ylsulphonyl)pyridine
- Molecular formula
- C10H14N2O2S
- Molecular weight
- 226.3
Names & synonyms
3-(Piperidin-1-ylsulphonyl)pyridineRefChem:495872688-367-93-(PIPERIDIN-1-YLSULFONYL)PYRIDINE26103-49-13-piperidin-1-ylsulfonylpyridineMFCD05149384Pyridine, 3-(1-piperidinylsulfonyl)-3-(piperidine-1-sulfonyl)pyridinePiperidine, 1-(3-pyridinylsulfonyl)-3-(1-piperidylsulfonyl)pyridineCHEMBL4565286
Show more names
3-(1-Piperidinylsulfonyl)pyridine1-(Pyridin-3-ylsulfonyl)piperidine1-(Pyridin-3-ylsulphonyl)piperidine3-(Piperidin-1-ylsulphonyl)pyridine98%3-(Piperidin-1-ylsulphonyl)pyridine 98%3-(Piperidin-1-ylsulphonyl)pyridine USP/EP/BP
SCHEMBL27083786SCHEMBL28254892DTXSID10394402AKOS010077621SB43833BS-22142CS-0211342Z751809918
Database identifiers
- CAS
26103-49-1- PubChem CID
- 3623948
- DTXSID
DTXSID10394402
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Melting point
- 88 · 88-89 °C
- Boiling point
- 381.3 · 381.3±34.0 °C(Predicted)
- Density
- 1.271 · 1.271±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.07 · 3.07±0.11(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- HS Code
- 2933399990 · 2933399990
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H319-H335-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Suppliers15 total
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
上海祺弘医药科技有限公司13482681346 18117455885 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…