Thionin perchlorate

CAT: 0024-sc-215974Size: 10 gDry Ice: NoHazardous: No

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CAT#:0024-sc-215974Size:10 g

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CAS Number

25137-58-0

Chemical Information

Perchloric acid--3-imino-3H-phenothiazin-7-amine (1/1)

CAS Number	25137-58-0
PubChem CID	9927409
IUPAC Name	(7-aminophenothiazin-3-ylidene)azanium perchlorate
Molecular Formula	C12H10ClN3O4S
Molecular Weight	327.74
Topological Polar Surface Area	164
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	0
Heavy Atom Count	21
Formal Charge	0
Complexity	484

SMILES

C1=CC2=C(C=C1N)SC3=CC(=[NH2+])C=CC3=N2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H9N3S.ClHO4/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9;2-1(3,4)5/h1-6,13H,14H2;(H,2,3,4,5)

InChIKey

GRBYIIMHBWPSQG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 25137-58-0

CID: 9927409

Formula: C12H10ClN3O4S

MW: 327.74

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	327.74
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	0
Exact Mass	327.0080547
Monoisotopic Mass	327.0080547
Topological Polar Surface Area	164 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	484
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
sc-215973A	Thionin acetate salt
sc-215973B	Thionin acetate salt
sc-215973C	Thionin acetate salt
sc-215973	Thionin acetate salt
sc-356122A	Tetraethylammonium perchlorate
sc-272582	Tetramethylammonium perchlorate
sc-294368	Diphenyliodonium Perchlorate
sc-253560	Silver perchlorate
sc-215260	Lithium perchlorate
sc-506248	Potassium perchlorate

Catalog	Name
HY-D1771	Thionin (perchlorate)
T87520-01	Thionin perchlorate
T19067-01	Thionin acetate
598474	Thionin chloride
HY-D0955-01	Thionin (acetate)
GT7720-10g	Thionin acetate salt
2702C 00025	Thionin (Acetate) For Microscopy
80599-01	Thionin Acetate, 90%
PS101-1	FD Thionin Solution™ (Regular Strength)