4-chloro-1-(2-fluorobenzyl)-3-nitro-1H-pyrazole
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Basic information
- CAS
1001500-06-6- Standard SMILES
O=[N+]([O-])c1nn(Cc2ccccc2F)cc1Cl- InChIKey
TWFAPXHLBPIXPJ-UHFFFAOYSA-N- Molecular formula
- C10H7ClFN3O2
- Average molar mass
- 255.63 g/mol
- Monoisotopic mass
- 255.0210823
Names & identifiers
- Preferred name
- 4-chloro-1-(2-fluorobenzyl)-3-nitro-1H-pyrazole
- IUPAC
- 4-chloro-1-[(2-fluorophenyl)methyl]-3-nitropyrazole
- English name
- 4-CHLORO-1-(2-FLUORO-BENZYL)-3-NITRO-1H-PYRAZOLE
- Molecular formula
- C10H7ClFN3O2
- Molecular weight
- 255.63
Names & synonyms
1001500-06-64-chloro-1-(2-fluorobenzyl)-3-nitro-1H-pyrazole4-Chloro-1-(2-fluoro-benzyl)-3-nitro-1H-pyrazole4-Chloro-1-[(2-fluorophenyl)methyl]-3-nitro-1H-pyrazole4-chloro-1-[(2-fluorophenyl)methyl]-3-nitropyrazole4-chloro-1-[(2-fluorophenyl)methyl]-3-nitro-pyrazoleMFCD04969178DTXSID801205235SBB021806STK312553AKOS000309364AKOS015922538
Show more names
AKOS B018702ART-CHEM-BB B0187021H-Pyrazole, 4-chloro-1-[(2-fluorophenyl)methyl]-3-nitro-
CS-0269617ST45091637EN300-229371
Database identifiers
- CAS
1001500-06-6- PubChem CID
- 7017487
- DTXSID
DTXSID801205235
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 289
Physicochemical properties
- HS Code
- 2933199090 · 2933199090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933199090
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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