Basic information
- CAS
143151-03-5- Standard SMILES
N#Cc1cc([N+](=O)[O-])c(N)cc1F- InChIKey
XAHREBHCCFVAHU-UHFFFAOYSA-N- Molecular formula
- C7H4FN3O2
- Average molar mass
- 181.12 g/mol
- Monoisotopic mass
- 181.02875459
Names & identifiers
- Preferred name
- 4-Amino-2-fluoro-5-nitrobenzonitrile
- IUPAC
- 4-amino-2-fluoro-5-nitrobenzonitrile
- English name
- 4-amino-2-fluoro-5-nitrobenzonitrile
- Molecular formula
- C7H4FN3O2
- Molecular weight
- 181.12
Names & synonyms
4-AMINO-2-FLUORO-5-NITROBENZONITRILE143151-03-5Benzonitrile, 4-amino-2-fluoro-5-nitro-4-amino-2-fluoro-5-nitro-benzonitrile4-cyano-5-fluoro-2-nitroanilineMFCD12828088SCHEMBL4584534-cyano-3-fluoro-6-nitroanilineDTXSID20439555XAHREBHCCFVAHU-UHFFFAOYSA-NAC4242AKOS015911681
Show more names
Benzonitrile,4-amino-2-fluoro-5-nitro-BS-25285SY250954CS-0208797EN300-396596F335729
Database identifiers
- CAS
143151-03-5- PubChem CID
- 10419793
- DTXSID
DTXSID20439555
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses4-Cyano-5-fluoro-2-nitroaniline, can be used in the synthesis of more complex oharmacetucal and biologically active compounds. It is used in the preparation of radiofluorinated quinoxalinedione derivatives as putative ligands of the AMPA receptor.
Suppliers16 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
苏州施亚生物科技有限公司17715136450 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海摩纹医药科技有限公司13681854265 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
聿锦（天津）科技有限公司13370351217 kungfu1217@1 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Related reactions
16 records
Compound notes
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