4-Chloro-5,8-difluoroquinoline - CAS 874781-04-1

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

Catalog:	BB038473
Product Name:	4-Chloro-5,8-difluoroquinoline
CAS:	874781-04-1
Synonyms:	4-chloro-5,8-difluoroquinoline

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-chloro-5,8-difluoroquinoline
Description:	4-Chloro-5,8-difluoroquinoline (CAS# 874781-04-1) is a useful research chemical.
Molecular Weight:	199.58
Molecular Formula:	C9H4ClF2N
Canonical SMILES:	C1=CC(=C2C(=C1F)C(=CC=N2)Cl)F
InChI:	InChI=1S/C9H4ClF2N/c10-5-3-4-13-9-7(12)2-1-6(11)8(5)9/h1-4H
InChI Key:	DZFRUXKPHJQFHH-UHFFFAOYSA-N
Boiling Point:	263.2 °C at 760 mmHg
Density:	1.455 g/cm³
MDL:	MFCD03407958
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
[1106917-71-8]C8H10ClF2NO
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[2367-82-0]C6H2F4
1,2,3,5-Tetrafluorobenzene
[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

[479552-94-8]C8H5F3N2O3S
1H-Pyrrolo[2,3-b]pyridin-4-yl trifluoromethanesulfonate
[1597-32-6]C5H5FN2
2-Amino-6-fluoropyridine
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[351-28-0]C8H8FNO
3'-Fluoroacetanilide
[2696462-69-6]C14H23N5O2Si
4-(4-Aminopyrimidin-2-yl)-2-methyl-1-(2-trimethylsilylethoxymethyl)pyrazol-3-one
[927800-47-3]C10H4Cl4FN
4-Chloro-6-fluoro-2-trichloromethyl-quinoline

Quinoline/Isoquinoline

[871507-15-2]C23H18N2O2
2-(Pyridin-4-yl)-1-(4-(quinolin-2-ylmethoxy)phenyl)ethan-1-one
[948291-36-9]C11H7Cl2NO
2,5-Dichloro-8-methylquinoline-3-carboxaldehyde
[203506-30-3]C11H12N2O
2-Amino-6-methoxy-3-methylquinoline
[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
[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
BR-102017019447-A2	COMPOUND, A PHARMACEUTICALLY ACCEPTABLE SALT, ISOMER OR MIXTURE OF THE SAME, PHARMACEUTICAL COMPOSITION, METHOD FOR TREATMENT OF A DISEASE OR CONDITION, INHIBITION OF THE ACTIVITY OF A FOSPHTIDILINOS OR CRISPID EIBASE OR EXIFIED CRISIS OR EFFECTS CANCER CELLS, KIT, AND, USE OF A COMPOUND, A PHARMACEUTICALLY ACCEPTABLE SALT, ISOMER OR A MIXTURE OF THE SAME	20160923
TW-201813963-A	Phospholipid creatinine 3-kinase inhibitor	20160923
US-10227350-B2	Phosphatidylinositol 3-kinase inhibitors	20160923
US-2018086768-A1	Phosphatidylinositol 3-kinase inhibitors	20160923
WO-2018057810-A1	Benzimidazole derivatives and their use as phosphatidylinositol 3-kinase inhibitors	20160923

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