8-Chloro-7-fluoroquinoline

CAT: 0926-JBD30592-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-JBD30592-01Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1909305-92-5

MDL Number

MFCD29047558

Smiles

C1=CC2=C (C (=C (C=C2) F) Cl) N=C1

Molecular Formula

C9H5ClFN

Molecular Weight

181.59 g/mol

Controlled

Chemical Information

8-Chloro-7-fluoroquinoline

CAS Number	1909305-92-5
PubChem CID	121553042
IUPAC Name	8-chloro-7-fluoroquinoline
Molecular Formula	C9H5ClFN
Molecular Weight	181.59
XLogP	2.9
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(=C(C=C2)F)Cl)N=C1

InChI

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

InChIKey

XZDSHDNATUPBOV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1909305-92-5

CID: 121553042

Formula: C9H5ClFN

MW: 181.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.59
XLogP3	2.9
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
SLB25176-01	8-Chloro-5-fluoroquinoline
CCA20053-01	6-Chloro-8-fluoroquinoline
XAA31988-01	8-Chloro-6-fluoroquinoline
DEA52668-01	7-Chloro-4-fluoroquinoline
AFC10795-01	7-Bromo-8-fluoroquinoline
LKC34944-01	7-Fluoroquinoline-8-carbaldehyde
YFB14880-01	4,7-Dichloro-8-fluoroquinoline
QSB09311-01	8-bromo-4-chloro-5-fluoroquinoline
UQB01673-01	8-bromo-4-chloro-6-fluoroquinoline
UQB01666	6-bromo-4-chloro-8-fluoroquinoline

Catalog	Name
439595-01	7-Chloro-8-fluoroquinoline
PC101758-01	8-Bromo-2-chloro-7-fluoroquinoline
438143-01	6-Bromo-7-chloro-8-fluoroquinoline
PC110007-01	7-Bromo-4-chloro-8-fluoroquinoline
OR1004468	7-Bromo-2-chloro-8-fluoroquinoline
PC1025368	8-Chloro-5-fluoroquinoline
PC1015478	8-Chloro-6-fluoroquinoline
sc-277271	4-Chloro-8-fluoroquinoline
PC520725-01	2-Chloro-8-fluoroquinoline
PC520731	6-Chloro-8-fluoroquinoline