Favipiravir Impurity 20

CAT: 1596-AR-F09807-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-F09807-01Size:10 Units

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

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CAS Number

1506611-77-3

Molecular Formula

C6H6BrN3O2

Molecular Weight

232.04

API Name

Favipiravir

Chemical Information

Methyl 3-amino-5-bromopyrazine-2-carboxylate

CAS Number	1506611-77-3
PubChem CID	83679623
IUPAC Name	methyl 3-amino-5-bromopyrazine-2-carboxylate
Molecular Formula	C6H6BrN3O2
Molecular Weight	232.03
XLogP	1.2
Topological Polar Surface Area	78.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	178

SMILES

COC(=O)C1=NC=C(N=C1N)Br

InChI

InChI=1S/C6H6BrN3O2/c1-12-6(11)4-5(8)10-3(7)2-9-4/h2H,1H3,(H2,8,10)

InChIKey

UOIGEEVYCPCIJV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1506611-77-3

CID: 83679623

Formula: C6H6BrN3O2

MW: 232.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	232.03
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	230.96434
Monoisotopic Mass	230.96434
Topological Polar Surface Area	78.1 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	178
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