3-Chloro-4-hydroxyquinoline

CAT: 0024-sc-289059Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-289059Size:250 mg

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CAS Number

58550-89-3

Chemical Information

3-Chloroquinolin-4-OL

CAS Number	58550-89-3
PubChem CID	12255325
IUPAC Name	3-chloro-1H-quinolin-4-one
Molecular Formula	C9H6ClNO
Molecular Weight	179.60
XLogP	2.4
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	237

SMILES

C1=CC=C2C(=C1)C(=O)C(=CN2)Cl

InChI

InChI=1S/C9H6ClNO/c10-7-5-11-8-4-2-1-3-6(8)9(7)12/h1-5H,(H,11,12)

InChIKey

GWCHTTSPSUWRBA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 58550-89-3

CID: 12255325

Formula: C9H6ClNO

MW: 179.60

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	179.60
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	179.0137915
Monoisotopic Mass	179.0137915
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	237
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-227116	7-Chloro-4-hydroxyquinoline
sc-289012A	3-Bromo-8-chloro-4-hydroxyquinoline
sc-289012	3-Bromo-8-chloro-4-hydroxyquinoline
sc-289005	3-Bromo-6-chloro-4-hydroxyquinoline
sc-289073	3-Chloro-6-bromo-4-hydroxyquinoline
sc-289073A	3-Chloro-6-bromo-4-hydroxyquinoline
sc-289005A	3-Bromo-6-chloro-4-hydroxyquinoline
sc-291283A	6-Chloro-4-hydroxyquinoline-3-carboxylic acid
sc-291283	6-Chloro-4-hydroxyquinoline-3-carboxylic acid
sc-291701A	8-Chloro-4-hydroxyquinoline-3-carboxylic acid

Catalog	Name
OR1075338	3-Chloro-4-hydroxyquinoline
OR307840	8-Chloro-4-hydroxyquinoline
FC42027	4-Chloro-7-hydroxyquinoline
OR83426-01	4-Chloro-6-hydroxyquinoline
OR183477-01	7-Chloro-4-hydroxyquinoline
OR307839-01	6-Chloro-4-hydroxyquinoline
EYB81071-01	3-Chloro-8-bromo-4-hydroxyquinoline
OR309324-01	3-Chloro-7-bromo-4-hydroxyquinoline
LCA33825-01	8-Chloro-4-hydroxyquinoline-3-carbonitrile
OR1076000	3-Bromo-7-chloro-4-hydroxyquinoline