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5,6-Dihydroxyindoline hydrobromide

CAT: 0024-sc-482222Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-482222Size:250 mg
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CAS Number
29539-03-5

Chemical Information

5,6-Dihydroxyindoline

Leukoaminochrome is a member of the class of indoles that is indoline with hydroxy substituents at positions 5 and 6. It has a role as a metabolite. It is a member of indoles and a member of catechols. It derives from a hydride of an indoline.

CAS Number29539-03-5
PubChem CID147311
IUPAC Name2,3-dihydro-1H-indole-5,6-diol
Molecular FormulaC8H9NO2
Molecular Weight151.16
XLogP1.2
Topological Polar Surface Area52.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity151
SMILES
C1CNC2=CC(=C(C=C21)O)O
InChI
InChI=1S/C8H9NO2/c10-7-3-5-1-2-9-6(5)4-8(7)11/h3-4,9-11H,1-2H2
InChIKey
VGSVNUGKHOVSPK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,6-Dihydroxyindoline
CAS: 29539-03-5
CID: 147311
Formula: C8H9NO2
MW: 151.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.16
XLogP31.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass151.063328530
Monoisotopic Mass151.063328530
Topological Polar Surface Area52.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity151
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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