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1-Chloro-2,5-difluoro-4-iodobenzene

1-Chloro-2,5-difluoro-4-iodobenzene - CAS 1097871-23-2

Catalog:	BB002541
Product Name:	1-Chloro-2,5-difluoro-4-iodobenzene
CAS:	1097871-23-2
Synonyms:	1-chloro-2,5-difluoro-4-iodobenzene; 1-chloro-2,5-difluoro-4-iodobenzene

Technical Data

Patents

Computed Properties

IUPAC Name:	1-chloro-2,5-difluoro-4-iodobenzene
Description:	1-Chloro-2,5-difluoro-4-iodobenzene (CAS# 1097871-23-2) is a useful research chemical.
Molecular Weight:	274.43
Molecular Formula:	C6H2ClF2I
Canonical SMILES:	C1=C(C(=CC(=C1Cl)F)I)F
InChI:	InChI=1S/C6H2ClF2I/c7-3-1-5(9)6(10)2-4(3)8/h1-2H
InChI Key:	JPIRZHIXWRVIAX-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	3.22280

Publication Number	Title	Priority Date
AU-2018332887-A1	Bisamide sarcomere activating compounds and uses thereof	20170913
CA-3075669-A1	Bisamide sarcomere activating compounds and uses thereof	20170913
KR-20200054237-A	Bisamide muscle fibrillar node activating compound and use thereof	20170913
TW-201920096-A	Diammine sarcomeric activation compound and use thereof	20170913
US-2019077793-A1	Bisamide sarcomere activating compounds and uses thereof	20170913

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Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	273.88578
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	273.88578
Rotatable Bond Count:	0
Topological Polar Surface Area:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4