4-Bromo-6-fluoroquinoline - CAS 661463-17-8

Name: 4-Bromo-6-fluoroquinoline
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB032924
Product Name:	4-Bromo-6-fluoroquinoline
CAS:	661463-17-8
Synonyms:	4-bromo-6-fluoroquinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-bromo-6-fluoroquinoline
Description:	4-Bromo-6-fluoroquinoline (CAS# 661463-17-8) is a useful research chemical.
Molecular Weight:	226.05
Molecular Formula:	C9H5BrFN
Canonical SMILES:	C1=CC2=NC=CC(=C2C=C1F)Br
InChI:	InChI=1S/C9H5BrFN/c10-8-3-4-12-9-2-1-6(11)5-7(8)9/h1-5H
InChI Key:	HIWPTYUKGHNQCU-UHFFFAOYSA-N
Boiling Point:	299.7 °C at 760 mmHg
Purity:	95 %
Density:	1.647 g/cm³
LogP:	3.13640

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Related Functional Groups

Fluorinated Building Blocks

[1946823-77-3]C7H9F3N2O
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[1211518-11-4]C4H2ClF3N4
4-chloro-6-(trifluoromethyl)-1,3,5-triazin-2-amine
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

Other Pyrimidines

[937601-34-8]C9H8BrN3O2
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[81290-20-2]C4H9F3Si
Trimethyl(trifluoromethyl)silane
[1489-53-8]C6H3F3
1,2,3-Trifluorobenzene
[77776-68-2]C6HCl3N4
2,4,8-Trichloropyrimido[5,4-d]pyrimidine
[1192570-20-9]C11H15F3N4O
2-Morpholino-2-(2-(trifluoromethyl)pyrimidin-5-yl)ethanamine

Quinoline/Isoquinoline

[203506-30-3]C11H12N2O
2-Amino-6-methoxy-3-methylquinoline
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[938001-63-9]C11H12ClN3
9-Chloro-1-methyl-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-b]quinoline
[891782-60-8]C9H8BrNO
7-Bromo-3,4-dihydro-2H-isoquinolin-1-one
[19490-87-0]C11H11NO
7-Methoxy-2-methylquinoline
[7651-83-4]C9H7NO
7-Isoquinolinol

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
CN-113045488-A	Indoleamine 2, 3-dioxygenase inhibitors	20191227
US-2021147386-A1	Pyrrolidine and piperidine compounds	20191106
WO-2021090245-A1	Pyrrolidine and piperidine compounds	20191106
WO-2020233676-A1	Amide-substituted imidazo compounds as selective inhibitors of indoleamine 2, 3-dioxygenases	20190522
WO-2020233677-A1	Process for preparing amide-substituted imidazo compounds	20190522

Complexity:	165
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	224.95894
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	224.95894
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3