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N,3,4-Trihydroxybenzamide structure
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N,3,4-Trihydroxybenzamide

TL;DR: N,3,4-Trihydroxybenzamide (CAS 69839-83-4) is a chemical compound with molecular formula C7H7NO4 and molecular weight 169.0375 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N,3,4-trihydroxybenzamide

Also Known As: Didox, N,3,4-Trihydroxybenzamide, 3,4-Dihydroxybenzohydroxamic acid, DIDO, Didox?

CAS Number
69839-83-4
Molecular Formula
C7H7NO4
Molecular Weight
169.0375 g/mol
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Application Areas

Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (11 patents) Analytical Reagents (2 patents) Biotechnology (6 patents) Organic Building Blocks (6 patents) Peptides & Amino Acids (8 patents)

Technical Specifications

Molecular FormulaC7H7NO4
Molecular Weight169.0375 g/mol
XLogP0.4
Topological Polar Surface Area (TPSA)89.8 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors4
Rotatable Bonds1
Exact Mass169.0375 Da
Heavy Atoms12
Complexity173.0
SMILESC1=CC(=C(C=C1C(=O)NO)O)O
InChIKeyQJMCKEPOKRERLN-UHFFFAOYSA-N

Product Description

Applications: N,3,4-Trihydroxybenzamide is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

N,3,4-Trihydroxybenzamide is a pharmaceutical intermediate identified by CAS number 69839-83-4 and the molecular formula C7H7NO4 and a molecular weight of 169.04 g/mol. Synonyms include Didox and N,3,4-Trihydroxybenzamide.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N,3,4-Trihydroxybenzamide

XLogP
0.4
TPSA (Topological Polar Surface Area)
89.8
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
4
Rotatable Bonds
1
Heavy Atoms
12
Complexity
173.0
Exact Mass
169.0375
Monoisotopic Mass
169.0375
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 N,3,4-Trihydroxybenzamide

The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,3,4-Trihydroxybenzamide. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for N,3,4-Trihydroxybenzamide. Following Lipinski's Rule of Five, N,3,4-Trihydroxybenzamide has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N,3,4-Trihydroxybenzamide?

The CAS number of N,3,4-Trihydroxybenzamide is 69839-83-4.

What is the molecular formula of N,3,4-Trihydroxybenzamide?

The molecular formula of N,3,4-Trihydroxybenzamide is C7H7NO4.

What is the molecular weight of N,3,4-Trihydroxybenzamide?

The molecular weight of N,3,4-Trihydroxybenzamide is 169.0375 g/mol.

What are the applications of N,3,4-Trihydroxybenzamide?

N,3,4-Trihydroxybenzamide is used in pharmaceutical synthesis routes and API production, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy N,3,4-Trihydroxybenzamide?

You can request a quote for N,3,4-Trihydroxybenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N,3,4-Trihydroxybenzamide?

Yes, CoreyChem provides custom synthesis services for N,3,4-Trihydroxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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