4-Chloro-2-methyl-7-(trifluoromethyl)quinoline - CAS 18529-09-4

Name: 4-Chloro-2-methyl-7-(trifluoromethyl)quinoline
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB014216
Product Name:	4-Chloro-2-methyl-7-(trifluoromethyl)quinoline
CAS:	18529-09-4
Synonyms:	4-chloro-2-methyl-7-(trifluoromethyl)quinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-2-methyl-7-(trifluoromethyl)quinoline
Description:	4-Chloro-2-methyl-7-(trifluoromethyl)quinoline (CAS# 18529-09-4) is a useful research chemical.
Molecular Weight:	245.63
Molecular Formula:	C11H7ClF3N
Canonical SMILES:	CC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=C1)Cl
InChI:	InChI=1S/C11H7ClF3N/c1-6-4-9(12)8-3-2-7(11(13,14)15)5-10(8)16-6/h2-5H,1H3
InChI Key:	KQXIMYKBHAMAAM-UHFFFAOYSA-N
Boiling Point:	277.2 °C at 760 mmHg
Density:	1.376 g/cm³
MDL:	MFCD00272334
LogP:	4.21540

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Related Functional Groups

Fluorinated Building Blocks

[1427357-61-6]C6H4FN3
6-Fluoro-[1,2,4]triazolo[1,5-a]pyridine
[1006473-17-1]C13H15F2N3
[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
[1866059-82-6]C4H6F4O2S
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[1820736-42-2]C11H11ClF3N3
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Other Pyrimidines

[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[832739-73-8]C10H6Cl2N2S
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[860790-29-0]C11H15F3N4
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
[45867-11-6]C5H4ClN3O2
2-Amino-5-chloro-4-pyrimidinecarboxylic acid
[944580-98-7]C8H5F3N2
8-(Trifluoromethyl)imidazo[1,2-a]pyridine

Quinoline/Isoquinoline

[938459-19-9]C11H10ClNS
2-Chloro-4-methyl-7-(methylthio)quinoline
[361982-79-8]C13H12ClN
2-Chloro-4-methyl-7,8-dihydro-6H-cyclopenta[g]quinoline
[91092-92-1]C11H9NO4
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[1394843-51-6]C10H8N2O4
3-Hydroxy-1-methyl-6-nitroquinolin-2(1H)-one
[391-02-6]C13H10F3NO3
Ethyl 4-hydroxy-7-trifluoromethyl-3-quinolinecarboxylate

GHS Hazard Statement:	H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]; H318 (90.48%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
EP-2621923-A1	N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases	20100929
EP-2621923-B1	N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases	20100929
ES-2624845-T3	N-heteroaryl compounds with cyclic bridge unit for the treatment of parasitic diseases	20100929
HU-E034347-T2	N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases	20100929
US-2013203768-A1	N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases	20100929

Complexity:	256
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	245.0219114
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	245.0219114
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.1