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1-(4-Fluorophenoxy)-3-iodobenzene

1-(4-Fluorophenoxy)-3-iodobenzene - CAS 188534-09-0

Name: 1-(4-Fluorophenoxy)-3-iodobenzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB014520
Product Name:	1-(4-Fluorophenoxy)-3-iodobenzene
CAS:	188534-09-0
Synonyms:	1-fluoro-4-(3-iodophenoxy)benzene; 1-fluoro-4-(3-iodophenoxy)benzene

Technical Data

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Computed Properties

IUPAC Name:	1-fluoro-4-(3-iodophenoxy)benzene
Description:	1-(4-Fluorophenoxy)-3-iodobenzene (CAS# 188534-09-0) is a useful research chemical.
Molecular Weight:	314.09
Molecular Formula:	C12H8FIO
Canonical SMILES:	C1=CC(=CC(=C1)I)OC2=CC=C(C=C2)F
InChI:	InChI=1S/C12H8FIO/c13-9-4-6-11(7-5-9)15-12-3-1-2-10(14)8-12/h1-8H
InChI Key:	JMULVRBKALQNIW-UHFFFAOYSA-N
Boiling Point:	324.6 °C at 760 mmHg
Density:	1.685 g/cm³
MDL:	MFCD00236611
LogP:	4.22260

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	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
Signal Word:	Warning

Publication Number	Title	Priority Date
EP-2616441-B1	Pyridine compounds and the uses thereof	20100917
US-2013303526-A1	Pyridine Compounds and the Uses Thereof	20100917
US-2015259293-A1	Pyridine compounds and the uses thereof	20100917
US-9056832-B2	Pyridine compounds and the users thereof	20100917
US-9611222-B2	Pyridine compounds and the uses thereof	20100917

Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	313.96039
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	313.96039
Rotatable Bond Count:	2
Topological Polar Surface Area:	9.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.2