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2-Chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde

2-Chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde - CAS 1621615-09-5

Catalog:	BB011842
Product Name:	2-Chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde
CAS:	1621615-09-5
Synonyms:	2-chloro-7-(trifluoromethyl)-3-quinolinecarboxaldehyde; 2-chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde
Description:	2-Chloro-7-(trifluoromethyl)quinoline-3-carbaldehyde (CAS# 1621615-09-5 ) is a useful research chemical.
Molecular Weight:	259.61
Molecular Formula:	C11H5ClF3NO
Canonical SMILES:	C1=CC(=CC2=NC(=C(C=C21)C=O)Cl)C(F)(F)F
InChI:	InChI=1S/C11H5ClF3NO/c12-10-7(5-17)3-6-1-2-8(11(13,14)15)4-9(6)16-10/h1-5H
InChI Key:	MPQTZOWCOJIVHN-UHFFFAOYSA-N
LogP:	3.71950

Publication Number	Title	Priority Date
AU-2016219906-A1	Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof	20150219
CN-107531699-A	It is fluorinated naphthane piperidinyl nonanoic acid derivatives and application thereof	20150219
EP-3259271-A2	Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof	20150219
JP-2018510139-A	Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and methods of use thereof	20150219
KR-20170117578-A	Fluorinated tetrahydronaphthyridinyl nonanoic acid derivatives and uses thereof	20150219

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Carbonyl Compounds

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Complexity:	297
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	259.001176
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	259.001176
Rotatable Bond Count:	1
Topological Polar Surface Area:	30
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5