4-Chloro-2-iodophenol

HCID 620234

Notes Reactions

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Basic information

CAS: 71643-66-8
Standard SMILES: Oc1ccc(Cl)cc1I
InChIKey: JKPLMQJLGBBFLO-UHFFFAOYSA-N
Molecular formula: C6H4ClIO
Average molar mass: 254.45 g/mol
Monoisotopic mass: 253.89954043

Names & identifiers

Preferred name: 4-Chloro-2-iodophenol
IUPAC: 4-chloro-2-iodophenol
English name: 4-Chloro-2-iodophenol
Molecular formula: C6H4ClIO
Molecular weight: 254.45

Names & synonyms

4-Chloro-2-iodophenol71643-66-8DTXSID70347333RefChem:98377DTXCID00298405615-320-1691-996-1JKPLMQJLGBBFLO-UHFFFAOYSA-N4-Chloro-2-iodo-phenol2-iodo-4-chlorophenolMFCD08235248Phenol, 4-chloro-2-iodo-

Show more names

4-chloro-2-iodo phenolAKOS015890624MB05977PS-7424AC-26935SY040773BCP08792AM82968

Database identifiers

CAS: 71643-66-8
PubChem CID: 620234
DTXSID: DTXSID70347333
EC Number: 615-320-1、691-996-1
Nikkaji: J338.589B

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 99.1

Physicochemical properties

Melting point: 75 to · 75.0 to 79.0 °C
Boiling point: 225.1 · 225.1±20.0 °C(Predicted)
Density: 2.087 · 2.087±0.06 g/cm3(Predicted)
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
form: powder to crystal
pka: 8.07 · 8.07±0.18(Predicted)
color: White to Orange to Green
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 319 · H319-H335-H302+H312+H332-H315
Precautionary statements: 261 · P261-P271-P280
Hazard Codes: Xi
Hazard Note: Irritant
HS Code: 2908190090 · 2908190090

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.

Not Classified

Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory.

Warning

H302 (50%): 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)