Zonisamide Impurity 9

CAT: 1299-RM-Z141909-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-Z141909-02Size:25 mg

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

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CAS Number

2320-33-4

Synonyms

3- (2-hydroxyphenyl) -3-oxopropanoic acid

Molecular Formula

C9H8O4

Molecular Weight

180.16

Target Alternative Name

Zonisamide

Product Name Synonym

3- (2-hydroxyphenyl) -3-oxopropanoic acid

Chemical Information

3-(2-Hydroxyphenyl)-3-oxopropanoic acid

CAS Number	2320-33-4
PubChem CID	12381315
IUPAC Name	3-(2-hydroxyphenyl)-3-oxopropanoic acid
Molecular Formula	C9H8O4
Molecular Weight	180.16
XLogP	1.8
Topological Polar Surface Area	74.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	212

SMILES

C1=CC=C(C(=C1)C(=O)CC(=O)O)O

InChI

InChI=1S/C9H8O4/c10-7-4-2-1-3-6(7)8(11)5-9(12)13/h1-4,10H,5H2,(H,12,13)

InChIKey

NXXULKGZNFWZEY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2320-33-4

CID: 12381315

Formula: C9H8O4

MW: 180.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	180.16
XLogP3	1.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	180.04225873
Monoisotopic Mass	180.04225873
Topological Polar Surface Area	74.6 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	212
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