Ribavirin Impurity 25

CAT: 1596-AR-R01512-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R01512-02Size:25 Units

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

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CAS Number

33949-18-7

Molecular Formula

C4H4N5O2. HSO4

Molecular Weight

154.11 97.06

API Name

Ribavirin

Chemical Information

hydrogen sulfate;5-methoxycarbonyl-1H-1,2,4-triazole-3-diazonium

CAS Number	33949-18-7
PubChem CID	176479314
IUPAC Name	hydrogen sulfate;5-methoxycarbonyl-1H-1,2,4-triazole-3-diazonium
Molecular Formula	C4H5N5O6S
Molecular Weight	251.18
Topological Polar Surface Area	182
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	284

SMILES

COC(=O)C1=NC(=NN1)[N+]#N.OS(=O)(=O)[O-]

InChI

InChI=1S/C4H3N5O2.H2O4S/c1-11-3(10)2-6-4(7-5)9-8-2;1-5(2,3)4/h1H3;(H2,1,2,3,4)

InChIKey

ALLAWKRFZCESPU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 33949-18-7

CID: 176479314

Formula: C4H5N5O6S

MW: 251.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	251.18
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	2
Exact Mass	250.99605407
Monoisotopic Mass	250.99605407
Topological Polar Surface Area	182 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	284
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	2
Compound Is Canonicalized	Yes

Catalog	Name
020635	α-Ribavirin (Ribavirin Impurity B)
MBS6041004-01	alpha-Ribavirin (Ribavirin Impurity B)
015183	Iso Ribavirin (Ribavirin Impurity G)
RM-R022235-01	Ribavirin Impurity 9
RM-R022234-01	Ribavirin Impurity 8
RM-R022222-01	Ribavirin Impurity V
RM-R022220-01	Ribavirin Impurity T
RM-R022219-01	Ribavirin Impurity S
RM-R022250-01	Ribavirin Impurity 24
RM-R022248-01	Ribavirin Impurity 22