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1-Fluoro-3-iodo-5-methoxybenzene

HCID 53399604
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Basic information

CAS
1167056-58-7
Standard SMILES
COc1cc(F)cc(I)c1
InChIKey
FLSYCEKFVMRKPY-UHFFFAOYSA-N
Molecular formula
C7H6FIO
Average molar mass
252.02 g/mol
Monoisotopic mass
251.94474

Names & identifiers

Preferred name
1-Fluoro-3-iodo-5-methoxybenzene
IUPAC
1-fluoro-3-iodo-5-methoxybenzene
English name
1-Fluoro-3-iodo-5-Methoxy-benzene
Molecular formula
C7H6FIO
Molecular weight
252.03

Names & synonyms

1-fluoro-3-iodo-5-methoxybenzene1167056-58-71-Fluoro-3-iodo-5-methoxy-benzeneBenzene, 1-fluoro-3-iodo-5-methoxy-MFCD12405142SCHEMBL15936181SCHEMBL30074410SWB05658AT12533BS-19287CS-0207640EN300-646090
Show more names
3-Fluoro-5-iodoanisole
F636370

Database identifiers

CAS
1167056-58-7
PubChem CID
53399604
EC Number
115-682-6

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Formal charge
0
Complexity
110

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

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.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

3-fluoro-5-iodophenol

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Compound notes

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