3-Aminocatechol

CAT: 0572-TRC-A603283-50MGSize: 50 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-A603283-50MGSize:50 mg

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CAS Number

20734-66-1

Synonyms

3-Aminopyrocatechol; 2,3-Dihydroxyaniline; 3-Amino-1,2-benzenediol;

Hazard Statement

No Data Available

Smiles

OC(C(O)=CC=C1)=C1N

Molecular Formula

C6H7NO2

Molecular Weight

125.13

InChI

InChI=1S/C6H7NO2/c7-4-2-1-3-5(8)6(4)9/h1-3,8-9H,7H2

Additionnal Information

IUPAC name: 3-aminobenzene-1,2-diol

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

Catecholamine

Catecholamine is a group of sympathetic amines containing a catechol group derived from the amino acid tyrosine. Catecholamines are hormones and neuromodulators synthesized in the chromaffin cells of the adrenal glands and the postganglionic fibers of the sympathetic nervous system in response to stress. Examples of catecholamines are epinephrine (adrenaline), norepinephrine (noradrenaline) and dopamine, all of which participate in a wide variety of functions throughout the body.

CAS Number	20734-66-1
PubChem CID	189460
IUPAC Name	3-aminobenzene-1,2-diol
Molecular Formula	C6H7NO2
Molecular Weight	125.13
XLogP	0.5
Topological Polar Surface Area	66.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	97

SMILES

C1=CC(=C(C(=C1)O)O)N

InChI

InChI=1S/C6H7NO2/c7-4-2-1-3-5(8)6(4)9/h1-3,8-9H,7H2

InChIKey

MGBKJKDRMRAZKC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20734-66-1

CID: 189460

Formula: C6H7NO2

MW: 125.13

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	125.13
XLogP3	0.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	125.047678466
Monoisotopic Mass	125.047678466
Topological Polar Surface Area	66.5 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	97.1
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

Related Products

Catalog	Name
TRC-A603280-25MG	4-Aminocatechol
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TRC-A603284-250MG	4-Aminocatechol Hydrochloride
TRC-T789890-500MG	3,3,3-Trifluoroalanine
TRC-T789890-1G	3,3,3-Trifluoroalanine
TRC-T789890-100MG	3,3,3-Trifluoroalanine
TRC-T872905-100MG	Tributyl 3,3',3''-Nitrilotripropionate
TRC-B440230-500MG	Ethyl 3,3,3-Trifluoropropanoate
P796392	Propionitrile-3,3,3-d3

Alternative Products

Catalog	Name
423938-01	3-Aminocatechol
002042	Aminocatechol
FA45794-01	4-Aminocatechol hydrobromide
260437-01	4-Aminocatechol HBr
PC6825	3,3,3-Trifluoropropyl 3,3,3-trifluoropropanoate
QMC01729-01	3- (3,3,3-Trifluoropropoxy) pyridine
JFC42829-01	3- (3,3,3-Trifluoropropyl) aniline
sc-260433	3- (3,3,3-Trifluoropropyl) heptamethyltrisiloxane
PDC53711-01	3- (3,3,3-Trifluoropropoxy) piperidine
NU-456L	3',3',3'-cAAG

3-Aminocatechol

Chemical Information

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