1-Chloro-4-fluoro-2-methyl-5-nitrobenzene - CAS 170098-88-1

Catalog:	BB012606
Product Name:	1-Chloro-4-fluoro-2-methyl-5-nitrobenzene
CAS:	170098-88-1
Synonyms:	1-chloro-4-fluoro-2-methyl-5-nitrobenzene; 1-chloro-4-fluoro-2-methyl-5-nitrobenzene

Technical Data

Patents

Computed Properties

IUPAC Name:	1-chloro-4-fluoro-2-methyl-5-nitrobenzene
Description:	1-Chloro-4-fluoro-2-methyl-5-nitrobenzene (CAS# 170098-88-1) is a useful research chemical.
Molecular Weight:	189.57
Molecular Formula:	C7H5ClFNO2
Canonical SMILES:	CC1=CC(=C(C=C1Cl)[N+](=O)[O-])F
InChI:	InChI=1S/C7H5ClFNO2/c1-4-2-6(9)7(10(11)12)3-5(4)8/h2-3H,1H3
InChI Key:	DPWZCTKTAOOLAK-UHFFFAOYSA-N
LogP:	3.21890

Publication Number	Title	Priority Date
CN-111377907-A	Polysubstituted phenylamino pyrimidine derivative and preparation method and application thereof	20181226
AU-2010311534-A1	(1,1, 1,3, 3, 3-hexafluoro-2-hydroxypropan-2-yl) phenyl derivatives, pharmaceutical compositions thereof and their use for the treatment of atherosclerosis	20091027
AU-2010311534-B2	(1,1, 1,3, 3, 3-hexafluoro-2-hydroxypropan-2-yl) phenyl derivatives, pharmaceutical compositions thereof and their use for the treatment of atherosclerosis	20091027
EP-2493855-A1	(1,1, 1,3, 3, 3-hexafluoro-2-hydroxypropan-2-yl) phenyl derivatives, pharmaceutical compositions thereof and their use for the treatment of atherosclerosis	20091027
EP-2493855-B1	(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl derivatives, pharmaceutical compositions thereof and their use for the treatment of atherosclerosis	20091027

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Related Functional Groups

Nitrogen Compounds

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[862649-86-3]
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Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.9992843
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	188.9992843
Rotatable Bond Count:	0
Topological Polar Surface Area:	45.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8