Basic information
- CAS
129485-83-2- Standard SMILES
c1ccc(-c2cc(-c3ccccn3)[nH]n2)nc1- InChIKey
IMDRKCUYKQQEAC-UHFFFAOYSA-N- Molecular formula
- C13H10N4
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.09054634
Names & identifiers
- Preferred name
- 3,5-Di(2-pyridyl)pyrazole
- IUPAC
- 2-(3-pyridin-2-yl-1H-pyrazol-5-yl)pyridine
- English name
- 3,5-Di(2-pyridyl)pyrazole
- Molecular formula
- C13H10N4
- Molecular weight
- 222.25
Names & synonyms
3,5-Di(2-pyridyl)pyrazoleRefChem:486572678-116-1129485-83-22,2'-(1H-Pyrazole-3,5-diyl)dipyridineMFCD001301252-(3-pyridin-2-yl-1H-pyrazol-5-yl)pyridine3,5-bis(2-pyridyl)pyrazole2-[3-(Pyridin-2-Yl)-1H-Pyrazol-5-Yl]PyridineSCHEMBL1528433Pyridine, 2,2'-(1H-pyrazole-3,5-diyl)bis-AS-64961
Show more names
Dipyridylpyrazole3,5-Di(2-pyridyl)pyrazole>2,2'-(1H-Pyrazole-3,5-diyl)dipyridine2-[5-(2-Pyridinyl)-1H-pyrazol-3-yl]pyridine
SY0525592-(5-pyridin-2-yl-2H-pyrazol-3-yl)pyridineorb3217116SCHEMBL29376325IMDRKCUYKQQEAC-UHFFFAOYSA-DTXSID50346642AKOS022180508AKOS025394293
Database identifiers
- CAS
129485-83-2- PubChem CID
- 613762
- DTXSID
DTXSID50346642- EC Number
- 678-116-1
- Nikkaji
- J1.949.552C、J236.006C
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Melting point
- 188 °C · 188 °C
- Boiling point
- 476.5 · 476.5±35.0 °C(Predicted)
- Density
- 1.248 · 1.248±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- solubility
- within almost transparency in hot Methanol
- form
- powder to crystal
- pka
- 9.96 · 9.96±0.19(Predicted)
- color
- White to Light yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- HS Code
- 2933.39 · 2933.39.9200
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 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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 CategoriesAcute Tox. 4 (50%)
Safety data
- hs_code
- 2933.39.9200
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Applications
Uses3,5-DI(2-PYRIDYL)PYRAZOLE is used as a ligand in the synthesis of MOF materials.
Upstream & downstream products
Upstream raw materials
Suppliers65 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
郑州德元凯化工有限公司17837139533 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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