2-Iodo-1-benzofuran

HCID 13831794

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 69626-75-1
Standard SMILES: Ic1cc2ccccc2o1
InChIKey: WIBOBANRAWSQLV-UHFFFAOYSA-N
Molecular formula: C8H5IO
Average molar mass: 244.03 g/mol
Monoisotopic mass: 243.93851278

Names & identifiers

Preferred name: 2-Iodo-1-benzofuran
IUPAC: 2-iodo-1-benzofuran
English name: 2-Iodo-benzofuran
Molecular formula: C8H5IO
Molecular weight: 244.03

Names & synonyms

69626-75-12-iodo-1-benzofuranDTXSID50550702RefChem:262136DTXCID00501486966-130-32-iodobenzofuranBenzofuran, 2-iodo-2-iodo-benzofuranMFCD18451197iodobenzofuranSCHEMBL3452249

Show more names

WLZ3233WIBOBANRAWSQLV-UHFFFAOYSA-NUCA62675BS-51676DA-03493SY226058CS-0146181D83864

Database identifiers

CAS: 69626-75-1
PubChem CID: 13831794
DTXSID: DTXSID50550702
EC Number: 966-130-3
Nikkaji: J929.212H

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 13.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 10
Formal charge: 0
Complexity: 126

Physicochemical properties

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338

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, 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.