5,6-Dihydroxy-1H-Indole

CAT: 1489-D6840Size: 250 mgDry Ice: NoHazardous: No

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CAT#:1489-D6840Size:250 mg

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CAS Number

3131-52-0

Purity

≥95%

Chemical Information

5,6-Dihydroxyindole

5,6-dihydroxyindole is a dihydroxyindole. It has a role as a mouse metabolite.

CAS Number	3131-52-0
PubChem CID	114683
IUPAC Name	1H-indole-5,6-diol
Molecular Formula	C8H7NO2
Molecular Weight	149.15
XLogP	1.3
Topological Polar Surface Area	56.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	151

SMILES

C1=CNC2=CC(=C(C=C21)O)O

InChI

InChI=1S/C8H7NO2/c10-7-3-5-1-2-9-6(5)4-8(7)11/h1-4,9-11H

InChIKey

SGNZYJXNUURYCH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3131-52-0

CID: 114683

Formula: C8H7NO2

MW: 149.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	149.15
XLogP3	1.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	149.047678466
Monoisotopic Mass	149.047678466
Topological Polar Surface Area	56.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151
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	1
Compound Is Canonicalized	Yes

Catalog	Name
I8190	1H-Indole
M3060-01	Methyl 6-Bromo-1H-Indole-4-Carboxylate
H7500-01	1H-Indazole-6-carboxaldehyde
B1300-01	1,3-Bis (2,6-Diisopropylphenyl) -4,5-Dihydro-1H-imidazol-3-iumchloride
B2300-01	1,3-Bis (2,6-Diisopropylphenyl) -4,5-Dihydro-1H-Imidazol-3-Iumtetrafluoroborate
E2120-01	5- (Ethylthio) -1H-Tetrazole
E2121-01	5- (Ethylthio) -1H-tetrazole
C2280-01	3-Chloro-1- (4-nitrophenyl) -5,6-dihydropyridin-2 (1H) -one
M6970-01	3-Morpholino-1- (4-nitrophenyl) -5,6-dihydropyridin-2 (1H) -one
S1083-01	5 (6) -TAMRA [5- (and-6) -Carboxytetramethylrhodamine] Mixed isomers

Catalog	Name
OR40006-01	5,6-Dihydroxy-1H-indole
KAA13114-01	Methyl 5,6-dihydroxy-1H-indole-2-carboxylate
FD143496-01	5,6-Dihydroxy-1H-indole-2-carboxylic acid
OR1054739-01	5,6-Dihydroxy-1-methyl-1H-indole-2-carboxylic acid
437197-01	5,6-Dihydroxy-1-methyl-1H-indole-2,3-dione
VRA13713-01	4,6-Dihydroxy-1H-indole-2-carboxylic acid
FBA87730-01	5,6-Dimethyl-1H-indole
RG-I140402-01	1H-Indole-5,6-Diol
PC7808-01	5,6-Difluoro-1H-indole
OR15747-01	5,6-Dichloro-1H-indole