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Catecholamine structure
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Catecholamine

TL;DR: Catecholamine (CAS 13608-28-1) is a chemical compound with molecular formula C6H7NO2 and molecular weight 125.047676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-aminobenzene-1,2-diol

Also Known As: 3-aminobenzene-1,2-diol, 3-aminocatechol, Catecholamine, 3-amino-1,2-benzenediol, Aminobenzenediol

CAS Number
13608-28-1
Molecular Formula
C6H7NO2
Molecular Weight
125.047676 g/mol
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Application Areas

Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (464 patents) Analytical Reagents (3092 patents) Biotechnology (5902 patents) Catalysts (45 patents) Coatings & Adhesives (7 patents)

Technical Specifications

Molecular FormulaC6H7NO2
Molecular Weight125.047676 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)66.5 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass125.047676 Da
Heavy Atoms9
Complexity97.0
SMILESC1=CC(=C(C(=C1)O)O)N
InChIKeyMGBKJKDRMRAZKC-UHFFFAOYSA-N

Chemical Property Profile of Catecholamine

XLogP
0.5
TPSA (Topological Polar Surface Area)
66.5
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
9
Complexity
97.0
Exact Mass
125.047676
Monoisotopic Mass
125.047676
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Catecholamine

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Catecholamine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Catecholamine. Following Lipinski's Rule of Five, Catecholamine has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Catecholamine?

The CAS number of Catecholamine is 13608-28-1.

What is the molecular formula of Catecholamine?

The molecular formula of Catecholamine is C6H7NO2.

What is the molecular weight of Catecholamine?

The molecular weight of Catecholamine is 125.047676 g/mol.

Where can I buy Catecholamine?

You can request a quote for Catecholamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Catecholamine?

Yes, CoreyChem provides custom synthesis services for Catecholamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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C3H7NO2 · MW 89.047676

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