Phenazine Methosulfate

CAT: 0127-OR1014611-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1014611-01Size:1 g

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CAS Number

299-11-6

MDL Number

MFCD00011923

Purity

98%

Smiles

COS(=O)(=O)[O-].C[n+]1c2ccccc2nc3ccccc13

Chemical Information

Phenazine Methosulfate

5-methylphenazinium methyl sulfate is an azaheterocycle sulfate salt and a member of phenazines.

CAS Number	299-11-6
PubChem CID	9285
IUPAC Name	5-methylphenazin-5-ium;methyl sulfate
Molecular Formula	C14H14N2O4S
Molecular Weight	306.34
Topological Polar Surface Area	91.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Heavy Atom Count	21
Formal Charge	0
Complexity	297

SMILES

C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31.COS(=O)(=O)[O-]

InChI

InChI=1S/C13H11N2.CH4O4S/c1-15-12-8-4-2-6-10(12)14-11-7-3-5-9-13(11)15;1-5-6(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

RXGJTUSBYWCRBK-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 299-11-6

CID: 9285

Formula: C14H14N2O4S

MW: 306.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	306.34
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	306.06742811
Monoisotopic Mass	306.06742811
Topological Polar Surface Area	91.6 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	297
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
BUP18253-01	Phenazine methylsulfate
OR18320-01	Phenazine
BIP0622-01	Phenazine ethosulphate
OR1036707	Camphor benzalkonium methosulfate
OR1026956-01	Phenazine-1-Carboxamide
OR1078939-01	Dibenzo[a, c]phenazine
OR5459-01	Phenazine-2,3-diamine
OR1052888-01	Phenazine-2,7-diamine
OR1043595	Benzo[a]phenazine 12-Oxide
OR01490-01	Phenazine-1-carboxylic acid

Catalog	Name
C7048-500	Phenazine methosulfate