2-Chloro-5-fluoroquinoline

CAT: 0127-PC1003366-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1003366-01Size:100 mg

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CAS Number

455955-27-8

MDL Number

MFCD10001462

Purity

95%

Smiles

FC1=C2C=CC(Cl)=NC2=CC=C1

Chemical Information

2-Chloro-5-fluoroquinoline

CAS Number	455955-27-8
PubChem CID	55263994
IUPAC Name	2-chloro-5-fluoroquinoline
Molecular Formula	C9H5ClFN
Molecular Weight	181.59
XLogP	3.3
Topological Polar Surface Area	12.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	165

SMILES

C1=CC2=C(C=CC(=N2)Cl)C(=C1)F

InChI

InChI=1S/C9H5ClFN/c10-9-5-4-6-7(11)2-1-3-8(6)12-9/h1-5H

InChIKey

QGVJVNBPDLHVHV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 455955-27-8

CID: 55263994

Formula: C9H5ClFN

MW: 181.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.59
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	181.0094550
Monoisotopic Mass	181.0094550
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	165
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC1025368	8-Chloro-5-fluoroquinoline
PC102052-01	4-Chloro-5-fluoroquinoline
PC1003563-01	5-Bromo-2-chloro-8-fluoroquinoline
PC404621-01	2-Chloro-6-fluoroquinoline
PC520725-01	2-Chloro-8-fluoroquinoline
PC404622	2-Chloro-7-fluoroquinoline
PC1864X	2-Chloro-3,8-dimethyl-5-fluoroquinoline
PC1002914-01	3-Bromo-5-chloro-6-fluoroquinoline
PC499015-01	8-Bromo-4-chloro-5-fluoroquinoline
PC508135-01	5-Bromo-4-chloro-8-fluoroquinoline

Catalog	Name
SLB25176-01	8-Chloro-5-fluoroquinoline
ZEA46721-01	2-Chloro-3-fluoroquinoline
417020-01	2-Chloro-6-fluoroquinoline
417076-01	2-Chloro-8-fluoroquinoline
QSB09311-01	8-bromo-4-chloro-5-fluoroquinoline
sc-288040A	2-Chloro-7-fluoroquinoline-3-carbonitrile
sc-287938	2-Chloro-3-ethyl-7-fluoroquinoline
sc-287929	2-Chloro-3-chloromethyl-7-fluoroquinoline
sc-288041	2-Chloro-7-fluoroquinoline-3-carboxaldehyde
sc-288004A	2-Chloro-6-fluoroquinoline-3-carbonitrile