4-Bromo-2,5-difluorobenzenesulfonamide

HCID 2773293

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 214209-98-0
Standard SMILES: NS(=O)(=O)c1cc(F)c(Br)cc1F
InChIKey: MINSVLXUGHJBPH-UHFFFAOYSA-N
Molecular formula: C6H4BrF2NO2S
Average molar mass: 272.07 g/mol
Monoisotopic mass: 270.91141791

Names & identifiers

Preferred name: 4-Bromo-2,5-difluorobenzenesulfonamide
IUPAC: 4-bromo-2,5-difluorobenzenesulfonamide
English name: 4-Bromo-2,5-difluorobenzenesulfonamide
Molecular formula: C6H4BrF2NO2S
Molecular weight: 272.07

Names & synonyms

4-bromo-2,5-difluorobenzenesulfonamide214209-98-0DTXSID30378345RefChem:290580DTXCID303293724-bromo-2,5-difluorobenzenesulphonamideMFCD015694634-bromo-2,5-difluorobenzene-1-sulfonamide4-bromo-2,5-difluoro-benzenesulfonamideSCHEMBL1510826SCHEMBL6038564MINSVLXUGHJBPH-UHFFFAOYSA-N

Show more names

BUTTPARK 23\07-784-BROMO-2,5-DIFLUORBenzenesulfonamide, 4-bromo-2,5-difluoro-4-Bromo-2,5-difluorobenzenesulphonamide97%4-BroMo-2,5-difluorobenzenesulfonaMide, 98+%

AKOS005254448FS-4540DB-037940ST50827278EN300-271007F005523

Database identifiers

CAS: 214209-98-0
PubChem CID: 2773293
DTXSID: DTXSID30378345
EC Number: 670-811-8

Properties

Computed structural properties

XLogP: 1.4
Topological polar surface area: 68.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 279

Physicochemical properties

Melting point: 167 · 167-169°C
storage temp.: 2 · 2-8°C
CAS DataBase Reference: 214209 · 214209-98-0(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Danger
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes: Xi
Hazard Note: Irritant
HS Code: 2935909099 · 2935909099

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (20%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.