4-Chloro-6,8-difluoroquinoline - CAS 239463-89-9

Name: 4-Chloro-6,8-difluoroquinoline
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB018257
Product Name:	4-Chloro-6,8-difluoroquinoline
CAS:	239463-89-9
Synonyms:	4-chloro-6,8-difluoroquinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-6,8-difluoroquinoline
Description:	4-Chloro-6,8-difluoroquinoline (CAS# 239463-89-9) is a useful research chemical.
Molecular Weight:	199.58
Molecular Formula:	C9H4ClF2N
Canonical SMILES:	C1=CN=C2C(=CC(=CC2=C1Cl)F)F
InChI:	InChI=1S/C9H4ClF2N/c10-7-1-2-13-9-6(7)3-5(11)4-8(9)12/h1-4H
InChI Key:	NBYDBLFWTPXYFH-UHFFFAOYSA-N
Boiling Point:	256.9 °C at 760 mmHg
Purity:	95 %
Density:	1.455 g/cm³
Appearance:	Solid
LogP:	3.16640

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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
[1820736-42-2]C11H11ClF3N3
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
[2454490-85-6]C16H17BF2O2
2-(7,8-Difluoro-1-naphthyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1018125-51-3]C12H12F3N3O2
2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

Other Pyrimidines

[452-76-6]C7H6F2
2,4-Difluorotoluene
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[13566-71-7]C10H8N2O2
4(3H)-Pyrimidinone,6-hydroxy-2-phenyl-
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate
[81290-20-2]C4H9F3Si
Trimethyl(trifluoromethyl)silane

Quinoline/Isoquinoline

[1936054-65-7]C11H9Cl2N
2,4-Dichloro-3,6-dimethylquinoline
[948291-36-9]C11H7Cl2NO
2,5-Dichloro-8-methylquinoline-3-carboxaldehyde
[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

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P264, P264+P265, P270, P280, P301+P317, P305+P354+P338, P317, P330, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2020352931-A1	Oxalamides as modulators of indoleamine 2,3-dioxygenase	20171212
US-2020095231-A1	Inhibitors of indoleamine 2,3-dioxygenase and methods of their use	20170512
WO-2018209049-A1	Inhibitors of indoleamine 2,3-dioxygenase and methods of their use	20170512
US-11066392-B2	Inhibitors of indoleamine 2,3-dioxygenase and methods of their use	20170512
AU-2017377852-A1	Pyrimidine tricyclic enone derivatives for inhibition of RORgamma and other uses	20161216

Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.0000331
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	199.0000331
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3