2,3,5-Trifluoro-6-nitroaniline

HCID 223085CAS 5415-62-3

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Basic information

Standard SMILES: Nc1c(F)c(F)cc(F)c1[N+](=O)[O-]
InChIKey: BQQVOARSGADABE-UHFFFAOYSA-N
Molecular formula: C6H3F3N2O2
Average molar mass: 192.1 g/mol
Monoisotopic mass: 192.014662

Names & identifiers

Preferred name: 2,3,5-Trifluoro-6-nitroaniline
IUPAC: 2,3,5-trifluoro-6-nitroaniline
English name: 3,5,6-Trifluoro-2-nitroaniline
Molecular formula: C6H3F3N2O2
Molecular weight: 192.1

Names & synonyms

2,3,5-trifluoro-6-nitroaniline5415-62-33,5,6-Trifluoro-2-nitroaniline2-Nitro-3,5,6-trifluoroanilineMFCD00971838NSC10265SCHEMBL7074819DTXSID30278836NSC-10265AKOS006230205BS-52971E78520

Show more names

2,3,5-trifluoro-6-nitro-aniline2,3,5-TRIFLUORO-6-NITROBENZENAMINE(2,3,5-trifluoro-6-nitro-phenyl)amineBenzenamine, 2,3,5-trifluoro-6-nitro-acetic acid [(8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-8,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] ester

FT-0614419A830000WLZ3376MFCD0097183,5,6-trifluoro-2-nitrophenylamineSBB0913652,3,5-tris(fluoranyl)-6-nitro-anilineSY491379

Database identifiers

CAS: 5415-62-3
PubChem CID: 223085
DTXSID: DTXSID30278836
Nikkaji: J2.288.027F

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 71.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 211

Physicochemical properties

storage temp.: 2 · 2-8°C
Symbol(GHS): 6 · GHS06
Signal word: Danger
Hazard statements: 301 · H301-H311-H331
Precautionary statements: 261 · P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
HS Code: 2921420090 · 2921420090

Safety & regulation

Safety data

hs_code: 2921420090
Signal word: Danger
Symbol(GHS): GHS06
Hazard statements: H301-H311-H331
Precautionary statements: P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501