Phloxin B

CAT: 0565-99529-03Size: 500 gDry Ice: NoHazardous: No

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CAT#:0565-99529-03Size:500 g

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Description

Part B

CAS Number

18472-87-2

Storage Temperature

2 - 8°C

Chemical Information

Acid Red 92

See also: Phloxine B (annotation moved to) ... View More ...

CAS Number	18472-87-2
PubChem CID	6433718
IUPAC Name	disodium;2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3-oxospiro[2-benzofuran-1,9'-xanthene]-3',6'-diolate
Molecular Formula	C20H2Br4Cl4Na2O5
Molecular Weight	829.6
Topological Polar Surface Area	81.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Heavy Atom Count	35
Formal Charge	0
Complexity	780

SMILES

C1=C2C(=C(C(=C1Br)[O-])Br)OC3=C(C(=C(C=C3C24C5=C(C(=C(C(=C5Cl)Cl)Cl)Cl)C(=O)O4)Br)[O-])Br.[Na+].[Na+]

InChI

InChI=1S/C20H4Br4Cl4O5.2Na/c21-5-1-3-17(9(23)15(5)29)32-18-4(2-6(22)16(30)10(18)24)20(3)8-7(19(31)33-20)11(25)13(27)14(28)12(8)26;;/h1-2,29-30H;;/q;2*+1/p-2

InChIKey

OOYIOIOOWUGAHD-UHFFFAOYSA-L

Chemical Structure

2D Structure

CAS: 18472-87-2

CID: 6433718

Formula: C20H2Br4Cl4Na2O5

MW: 829.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	829.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	829.51147
Monoisotopic Mass	823.51852
Topological Polar Surface Area	81.7 Å²
Heavy Atom Count	35
Formal Charge	0
Complexity	780
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	3
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
02002 00100	Phloxin B For Microscopy
116780 100	Phloxin B for Microscopy (C.l. No. 45410)
314775-01	Phloxin B for Microscopy (C.l. No. 45410) 80.0%

Phloxin B

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