8-Bromoquinoline

CAT: 0024-sc-254914Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-254914Size:500 mg

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CAS Number

16567-18-3

Chemical Information

8-Bromoquinoline

CAS Number	16567-18-3
PubChem CID	140109
IUPAC Name	8-bromoquinoline
Molecular Formula	C9H6BrN
Molecular Weight	208.05
XLogP	2.5
Topological Polar Surface Area	12.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	138

SMILES

C1=CC2=C(C(=C1)Br)N=CC=C2

InChI

InChI=1S/C9H6BrN/c10-8-5-1-3-7-4-2-6-11-9(7)8/h1-6H

InChIKey

PIWNKSHCLTZKSZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 16567-18-3

CID: 140109

Formula: C9H6BrN

MW: 208.05

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	208.05
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	206.96836
Monoisotopic Mass	206.96836
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	138
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
sc-267988	5-Bromoquinoline-8-carbaldehyde
sc-267988A	5-Bromoquinoline-8-carbaldehyde
sc-351316A	6-bromoquinoline-8-carboxylic acid
sc-351316	6-bromoquinoline-8-carboxylic acid
sc-259722	2-Bromoquinoline
sc-259722A	2-Bromoquinoline
sc-207101	6-Bromoquinoline
sc-479268A	7-Bromoquinoline
sc-267987	5-Bromoquinoline
sc-479268	7-Bromoquinoline

Catalog	Name
440057-01	8-Bromoquinoline
440058-01	8-Bromoquinoline, HCl
YXC90519-01	7-Bromoquinoline-8-carbaldehyde
260919-01	4-Amino-8-bromoquinoline
OR85041-01	4-Bromoquinoline-8-carbonitrile
OR1012100-01	8-Nitro-3-Bromoquinoline
GTR19254461-01	5-Bromoquinoline-8-carbonitrile
GCC60690-01	6-bromoquinoline-8-carbaldehyde
234984-01	8-Bromoquinoline ≥97% (GC)
OR1040629-01	8-Bromoquinoline-4-carbaldehyde