CAS 6797-79-1 4-Chloro-2-fluoro-1-iodobenzene (HCID 2736562)

Names & identifiers

Preferred name: 4-Chloro-2-fluoro-1-iodobenzene
IUPAC: 4-chloro-2-fluoro-1-iodobenzene
English name: 4-Chloro-2-fluoroiodobenzene
Molecular formula: C6H3ClFI
Molecular weight: 256.44

Names & synonyms

6797-79-14-Chloro-2-fluoro-1-iodobenzeneRSTFBOIFYXJIMR-UHFFFAOYSA-DTXSID00987367RefChem:98360DTXCID501414532614-191-9InChI=1/C6H3ClFI/c7-4-1-2-6(9)5(8)3-4/h1-3H4-Chloro-2-fluoroiodobenzene2-fluoro-4-chloroiodobenzeneMFCD000797291-chloro-3-fluoro-4-iodobenzene

Show more names

2-Fluoro-4-chloro-1-iodobenzene2-Fluoro--4-chloro-iodobenzene*4-Chloro-2-fluoroiodobenzene99%4-Chloro-2-fluoroiodobenzene 99%Benzene, 4-chloro-2-fluoro-1-iodo-4-Chloro-2-fluoro-1-iodobenzene >

4-chloro-2-fluoro-1-iodo-benzene6997-79-13-fluoro-4-iodochlorobenzene4-CHLORO-2-FLUORO-IODOBENZENE2-iodo-5-chlorofluorobenzene2-iodo-5-chlorofluoro benzene4-Chloro-2-fluoroiodobenzene, 98%AKOS009157520

Database identifiers

CAS: 6797-79-1
PubChem CID: 2736562
DTXSID: DTXSID00987367
ChEMBL: CHEMBL2263228
EC Number: 614-191-9
Nikkaji: J1.424.747E

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 99.1

Physicochemical properties

Melting point: 17 · 17-19
Boiling point: 217 °C · 217 °C(lit.)
Density: 1.98 g/mL · 1.98 g/mL at 25 °C(lit.)
refractive index: 20 · n20/D 1.606(lit.)
Flash point: 230 °F · >230 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
form: powder to lump to clear liquid
color: White or Colorles to Yellow to Orange
Sensitive: Light Sensitive
BRN: 6288419 · 6288419
InChI: 1S/C6H3ClFI/c7-4-1-2-6(9)5(8)3-4/h1-3H
InChIKey: RSTFBOIFYXJIMR-UHFFFAOYSA-N
SMILES: Fc1cc(Cl)ccc1I
CAS DataBase Reference: 6797 · 6797-79-1(CAS DataBase Reference)
UNSPSC Code: 12352100 · 12352100
NACRES: 22 · NA.22
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs: Respiratory system
PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
HazardClass: IRRITANT
HS Code: 29039990 · 29039990
Storage Class: 10 · 10 - Combustible liquids
Hazard Classifications: 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 48 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE: Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk: 3
hs_code: 29039990
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
hazard_class: IRRITANT
Storage Class: 10 - Combustible liquids
target organs: Respiratory system
Hazard statements: H315-H319-H335
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications

Uses4-Chloro-2-fluoroiodobenzene (2-Iodo-5-chlorofluorobenzene) is a 2,4-dihalofluorobenzene derivative. 2-Iodo-5-chlorofluorobenzene can be prepared from aniline.

General Description4-Chloro-2-fluoroiodobenzene (2-Iodo-5-chlorofluorobenzene) is a 2,4-dihalofluorobenzene derivative. 2-Iodo-5-chlorofluorobenzene can be prepared from aniline.