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2,6-Dichlorophenol Indophenol Sodium SaL 98% AR

CAT: 1507-97400025Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1507-97400025Size:25 mg
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CAS Number
620-45-1
HSN Code
29252990

Chemical Information

2,6-Dichloroindophenol sodium

2,6-Dichlorophenolindophenol sodium salt is an organic molecular entity.

CAS Number620-45-1
PubChem CID23697355
IUPAC Namesodium 4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate
Molecular FormulaC12H6Cl2NNaO2
Molecular Weight290.07
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity400
SMILES
C1=CC(=CC=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)[O-].[Na+]
InChI
InChI=1S/C12H7Cl2NO2.Na/c13-10-5-8(6-11(14)12(10)17)15-7-1-3-9(16)4-2-7;/h1-6,16H;/q;+1/p-1
InChIKey
CVSUAFOWIXUYQA-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 2,6-Dichloroindophenol sodium
CAS: 620-45-1
CID: 23697355
Formula: C12H6Cl2NNaO2
MW: 290.07
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight290.07
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass288.9673281
Monoisotopic Mass288.9673281
Topological Polar Surface Area52.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity400
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes