Basic information
- CAS
26820-61-1- Standard SMILES
O=[N+]([O-])c1ccc(N2CCCCC2)nc1- InChIKey
RQPFYHQIEVITPC-UHFFFAOYSA-N- Molecular formula
- C10H13N3O2
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.10077667
Overview
5-nitro-2-(1-piperidinyl)pyridine is a C-nitro compound.
Names & identifiers
- Preferred name
- 5-Nitro-2-piperidinopyridine
- IUPAC
- 5-nitro-2-piperidin-1-ylpyridine
- English name
- 5-Nitro-2-piperidinopyridine
- Molecular formula
- C10H13N3O2
- Molecular weight
- 207.23
Names & synonyms
5-Nitro-2-piperidinopyridine5-Nitro-2-(1-piperidinyl)pyridineRefChem:537410683-735-526820-61-15-nitro-2-(piperidin-1-yl)pyridine5-nitro-2-piperidin-1-ylpyridinePiperidine, 5-nitro-2-pyridyl-Pyridine, 5-nitro-2-(1-piperidinyl)-5-Nitro-2-(piperidine-1-yl)pyridine5'-Nitro-3,4,5,6-tetrahydro-2H-[1,2']bipyridinylMFCD00086192
Show more names
2-Piperidino-5-nitropyridine
VAV397C9AE2-(1-Piperidino)-5-nitropyridineNSC-1025115-nitro-2-piperidylpyridineNSC 102511BRN 0210853NSC102511CBMicro_021172
Database identifiers
- CAS
26820-61-1- PubChem CID
- 97158
- DTXSID
DTXSID70181315- ChEMBL
CHEMBL1610622- ChEBI
CHEBI:108068- UNII
- VAV397C9AE
- EC Number
- 683-735-5
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 62 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Solubility29.2 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Melting point
- 83 · 83-84℃
- Boiling point
- 380.4 · 380.4±27.0 °C(Predicted)
- Density
- 1.242 · 1.242
- pka
- 4.63 · 4.63±0.29(Predicted)
- FDA UNII
- 397 C9AE · VAV397C9AE
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
- 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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Suppliers15 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
江阴安博生物医药有限公司086-010-62176588 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
上海逐耀医药科技有限公司18321033991 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
四川铂友生物科技有限公司（原四川佰朋）028-65791793 18140026355 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
宝鸡缔都医药化工有限公司
Related reactions
3 records
Compound notes
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