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1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone structure
Fine Chemical

1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone

TL;DR: 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone (CAS 1110502-50-5) is a chemical compound with molecular formula C13H16Cl2O4 and molecular weight 306.04257 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one

Also Known As: Dictyostelium, Dif-1 (dictyostelium), DIF factor, nchembio811-comp1, 1-((3,5-dichloro)-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone

CAS Number
1110502-50-5
Molecular Formula
C13H16Cl2O4
Molecular Weight
306.04257 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Organic Building Blocks (12 patents) Pharmaceutical Intermediates (3 patents)

Technical Specifications

Molecular FormulaC13H16Cl2O4
Molecular Weight306.04257 g/mol
XLogP4.6
Topological Polar Surface Area (TPSA)66.8 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds6
Exact Mass306.04257 Da
Heavy Atoms19
Complexity284.0
SMILESCCCCCC(=O)C1=C(C(=C(C(=C1O)Cl)OC)Cl)O
InChIKeyVUDQSRFCCHQIIU-UHFFFAOYSA-N

Chemical Property Profile of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone

XLogP
4.6
TPSA (Topological Polar Surface Area)
66.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
6
Heavy Atoms
19
Complexity
284.0
Exact Mass
306.04257
Monoisotopic Mass
306.04257
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 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone

The XLogP value of 4.6 indicates that 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone. Following Lipinski's Rule of Five, 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone has 2 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 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone?

The CAS number of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone is 1110502-50-5.

What is the molecular formula of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone?

The molecular formula of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone is C13H16Cl2O4.

What is the molecular weight of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone?

The molecular weight of 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone is 306.04257 g/mol.

Where can I buy 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone?

You can request a quote for 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone?

Yes, CoreyChem provides custom synthesis services for 1-(3,5-Dichloro-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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