Basic information
- CAS
57964-55-3- Standard SMILES
c1ccc2[nH]c(-c3cn[nH]c3)nc2c1- InChIKey
KNPMWQGAFZKQTE-UHFFFAOYSA-N- Molecular formula
- C10H8N4
- Average molar mass
- 184.2 g/mol
- Monoisotopic mass
- 184.07489627
Names & identifiers
- Preferred name
- 2-(1H-pyrazol-4-yl)-1H-1,3-benzodiazole
- IUPAC
- 2-(1H-pyrazol-4-yl)-1H-benzimidazole
- English name
- 1H-Benzimidazole,2-(1H-pyrazol-4-yl)-(9CI)
- Molecular formula
- C10H8N4
- Molecular weight
- 184.2
Names & synonyms
57964-55-32-(1H-PYRAZOL-4-YL)-1H-1,3-BENZODIAZOLERefChem:451507848-405-92-(1H-pyrazol-4-yl)-1H-benzo[d]imidazole2-(1h-pyrazol-4-yl)-1h-benzimidazoleSCHEMBL7257869SCHEMBL110880722-(4-pyrazolyl)-1h-benzimidazoleHCA96455AKOS012380684CS-0232472
Show more names
1H-Benzimidazole, 2-(1H-pyrazol-4-yl)-1H-Benzimidazole,2-(1H-pyrazol-4-yl)-(9CI)
EN300-1272821
Database identifiers
- CAS
57964-55-3- PubChem CID
- 12377413
- EC Number
- 848-405-9
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H319-H315-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
CHEMSTEP[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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