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3,5-Dibromo-2,4-dihydroxybenzaldehyde structure
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3,5-Dibromo-2,4-dihydroxybenzaldehyde

TL;DR: 3,5-Dibromo-2,4-dihydroxybenzaldehyde (CAS 116096-91-4) is a chemical compound with molecular formula C7H4Br2O3 and molecular weight 293.85272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,5-dibromo-2,4-dihydroxybenzaldehyde

Also Known As: 3,5-dibromo-2,4-dihydroxybenzaldehyde, starbld0009741, Benzaldehyde, 3,5-dibromo-2,4-dihydroxy-, 3,5-dibromo-2,4-dihydroxy benzaldehyde, 2,4-dihydroxy-3,5-dibromobenzaldehyde

CAS Number
116096-91-4
Molecular Formula
C7H4Br2O3
Molecular Weight
293.85272 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (4 patents)

Technical Specifications

Molecular FormulaC7H4Br2O3
Molecular Weight293.85272 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)57.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass293.85272 Da
Heavy Atoms12
Complexity176.0
SMILESC1=C(C(=C(C(=C1Br)O)Br)O)C=O
InChIKeyJEFPULPKKGELPK-UHFFFAOYSA-N

Chemical Property Profile of 3,5-Dibromo-2,4-dihydroxybenzaldehyde

XLogP
3.7
TPSA (Topological Polar Surface Area)
57.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
12
Complexity
176.0
Exact Mass
293.85272
Monoisotopic Mass
293.85272
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 3,5-Dibromo-2,4-dihydroxybenzaldehyde

The XLogP value of 3.7 indicates that 3,5-Dibromo-2,4-dihydroxybenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 3,5-Dibromo-2,4-dihydroxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dibromo-2,4-dihydroxybenzaldehyde has 2 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 3,5-Dibromo-2,4-dihydroxybenzaldehyde?

The CAS number of 3,5-Dibromo-2,4-dihydroxybenzaldehyde is 116096-91-4.

What is the molecular formula of 3,5-Dibromo-2,4-dihydroxybenzaldehyde?

The molecular formula of 3,5-Dibromo-2,4-dihydroxybenzaldehyde is C7H4Br2O3.

What is the molecular weight of 3,5-Dibromo-2,4-dihydroxybenzaldehyde?

The molecular weight of 3,5-Dibromo-2,4-dihydroxybenzaldehyde is 293.85272 g/mol.

Where can I buy 3,5-Dibromo-2,4-dihydroxybenzaldehyde?

You can request a quote for 3,5-Dibromo-2,4-dihydroxybenzaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3,5-Dibromo-2,4-dihydroxybenzaldehyde?

Yes, CoreyChem provides custom synthesis services for 3,5-Dibromo-2,4-dihydroxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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