IOX1 50mg

CAT: 0628-A14277-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A14277-50Size:50 mg

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CAS Number

5852-78-8

Chemical Information

8-Hydroxy-5-quinolinecarboxylic acid

8-hydroxy-5-quinolinecarboxylic acid is a member of quinolines.

CAS Number	5852-78-8
PubChem CID	459617
IUPAC Name	8-hydroxyquinoline-5-carboxylic acid
Molecular Formula	C10H7NO3
Molecular Weight	189.17
XLogP	1.8
Topological Polar Surface Area	70.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	231

SMILES

C1=CC2=C(C=CC(=C2N=C1)O)C(=O)O

InChI

InChI=1S/C10H7NO3/c12-8-4-3-7(10(13)14)6-2-1-5-11-9(6)8/h1-5,12H,(H,13,14)

InChIKey

JGRPKOGHYBAVMW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5852-78-8

CID: 459617

Formula: C10H7NO3

MW: 189.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	189.17
XLogP3	1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	189.042593085
Monoisotopic Mass	189.042593085
Topological Polar Surface Area	70.4 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	231
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