4-Fluoro-2-methyl-5-nitroaniline

HCID 19035271

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Basic information

CAS: 446-18-4
Standard SMILES: Cc1cc(F)c([N+](=O)[O-])cc1N
InChIKey: LHIUCVZCVMTRNG-UHFFFAOYSA-N
Molecular formula: C7H7FN2O2
Average molar mass: 170.14 g/mol
Monoisotopic mass: 170.04915568

Names & identifiers

Preferred name: 4-Fluoro-2-methyl-5-nitroaniline
IUPAC: 4-fluoro-2-methyl-5-nitroaniline
English name: Benzenamine, 4-fluoro-2-methyl-5-nitro-
Molecular formula: C7H7FN2O2
Molecular weight: 170.14

Names & synonyms

4-fluoro-2-methyl-5-nitroaniline446-18-4DTXSID30597594RefChem:292779DTXCID80548354966-418-9MFCD18824947Benzenamine,4-fluoro-2-methyl-5-nitro-SCHEMBL15215082-amino-5-fluoro-4-nitrotolueneLHIUCVZCVMTRNG-UHFFFAOYSA-N4-fluoro-2-methyl-5-nitro-aniline

Show more names

Benzenamine, 4-fluoro-2-methyl-5-nitro-

4-Fluoro-2-methyl-5-nitrobenzenamineAKOS0272545484-Fluoro-2-methyl-5-nitro-phenylamineDS-10392SY040947Benzenamine, 4-fluoro-2-methyl-5-nitro-DB-099945CS-0083167

Database identifiers

CAS: 446-18-4
PubChem CID: 19035271
DTXSID: DTXSID30597594
EC Number: 966-418-9

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 71.8 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 0
Heavy atoms: 12
Formal charge: 0
Complexity: 183

Physicochemical properties

storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Appearance: Light yellow to brown Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H332-H335
Precautionary statements: 280 · P280-P305+P351+P338-P310
HS Code: 2921490090 · 2921490090

Safety & regulation

GHS classification

GHS Classification · 4 items

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, P317, 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.