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Dhq-5-CA structure
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Dhq-5-CA

TL;DR: Dhq-5-CA (CAS 115225-74-6) is a chemical compound with molecular formula C20H18O3 and molecular weight 306.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

12,19-dimethyl-4-oxapentacyclo[9.8.0.02,8.03,5.013,18]nonadeca-1(19),2(8),9,11,13,15,17-heptaene-6,7-diol

Also Known As: Dhq-5-CA, Decahydroquinoline-5-carboxylic acid, cis-Decahydroquinoline-5-carboxylic acid, 1,2,3-trichloro-4-(2,4-dichlorophenoxy)benzene, J1.914.151I

CAS Number
115225-74-6
Molecular Formula
C20H18O3
Molecular Weight
306.12558 g/mol
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Technical Specifications

Molecular FormulaC20H18O3
Molecular Weight306.12558 g/mol
XLogP2.7
Topological Polar Surface Area (TPSA)53.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds0
Exact Mass306.12558 Da
Heavy Atoms23
Complexity480.0
SMILESCC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)C)C5C(O5)C(C3O)O
InChIKeySZIWZGXOWBSPTO-UHFFFAOYSA-N

Chemical Property Profile of Dhq-5-CA

XLogP
2.7
TPSA (Topological Polar Surface Area)
53.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
0
Heavy Atoms
23
Complexity
480.0
Exact Mass
306.12558
Monoisotopic Mass
306.12558
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 Dhq-5-CA

The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dhq-5-CA. With a topological polar surface area (TPSA) of 53.0 Ų, Dhq-5-CA exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dhq-5-CA 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 Dhq-5-CA?

The CAS number of Dhq-5-CA is 115225-74-6.

What is the molecular formula of Dhq-5-CA?

The molecular formula of Dhq-5-CA is C20H18O3.

What is the molecular weight of Dhq-5-CA?

The molecular weight of Dhq-5-CA is 306.12558 g/mol.

Where can I buy Dhq-5-CA?

You can request a quote for Dhq-5-CA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Dhq-5-CA?

Yes, CoreyChem provides custom synthesis services for Dhq-5-CA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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