Granisetron EP Impurity H

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CAT#:1596-AR-G01608-01Size:50 Units

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

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CAS Number

4498-67-3

Synonyms

1H-indazole-3-carboxylicacid;1H-Indazole-3-carboxylic Acid; 3 (1H) -Indazolecarboxylic Acid; 3-Carboxy-1H-indazole; 3-Carboxyindazole; NSC 520610

Molecular Formula

C8H6N2O2

Molecular Weight

162.15

API Name

Granisetron

Chemical Information

Indazole-3-carboxylic acid

derivatives of above cpd are often antispermatogenic agents

CAS Number	4498-67-3
PubChem CID	78250
IUPAC Name	1H-indazole-3-carboxylic acid
Molecular Formula	C8H6N2O2
Molecular Weight	162.15
XLogP	1.4
Topological Polar Surface Area	66
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	195

SMILES

C1=CC=C2C(=C1)C(=NN2)C(=O)O

InChI

InChI=1S/C8H6N2O2/c11-8(12)7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H,9,10)(H,11,12)

InChIKey

BHXVYTQDWMQVBI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4498-67-3

CID: 78250

Formula: C8H6N2O2

MW: 162.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.15
XLogP3	1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	162.042927438
Monoisotopic Mass	162.042927438
Topological Polar Surface Area	66 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	195
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
AR-G01610-01	Granisetron EP Impurity A
AR-G01609-01	Granisetron EP Impurity F (exo-Granisetron)
AR-G01603-01	Granisetron EP Impurity B
AR-G01606-01	Granisetron EP Impurity E
AR-G01611-01	Granisetron EP Impurity D
AR-G01605-01	Granisetron EP Impurity I
AR-G01607-01	Granisetron EP Impurity G
AR-G01604-01	Granisetron EP Impurity C HCl
AR-G02762-01	N-Nitroso Granisetron EP Impurity C
AR-G02754-01	Granisetron Impurity 3

Catalog	Name
sc-218455	Exo-Granisetron (Granisetron Impurity F)
TRC-D292038-5MG	1-Desmethyl Granisetron (Granisetron Impurity B)
RM-G121933-01	Granisetron Impurity 33
RM-G121916-01	Granisetron Impurity 16
RM-G121924-01	Granisetron Impurity 24
RM-G121943-01	Granisetron Impurity 43
RM-G121942-01	Granisetron Impurity 42
RM-G121901-01	Granisetron EP Impurity A
RM-G121931-01	Granisetron Impurity 31
RM-G121930-01	Granisetron Impurity 30