4-chloro-1-cyclopentyl-3-nitro-1H-pyrazole
Basic information
- CAS
1341648-03-0- Standard SMILES
O=[N+]([O-])c1nn(C2CCCC2)cc1Cl- InChIKey
PZFGFGNMVJNXFH-UHFFFAOYSA-N- Molecular formula
- C8H10ClN3O2
- Average molar mass
- 215.64 g/mol
- Monoisotopic mass
- 215.0461543
Names & identifiers
- Preferred name
- 4-chloro-1-cyclopentyl-3-nitro-1H-pyrazole
- IUPAC
- 4-chloro-1-cyclopentyl-3-nitropyrazole
Names & synonyms
4-chloro-1-cyclopentyl-3-nitro-1H-pyrazole1341648-03-0RefChem:520758875-568-3AKOS013357092EN300-5012172
Database identifiers
- CAS
1341648-03-0- PubChem CID
- 64040474
- EC Number
- 875-568-3
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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