DNCO
TL;DR: DNCO (CAS 64267-66-9) is a chemical compound with molecular formula C24H17ClO9 and molecular weight 484.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl) 3-chlorobenzoate
Also Known As: DNCO, 8-(3-Chlorobenzoyloxy)-9-hydroxy-8,9-dihydro-aflatoxin B1, Cyclopenta(c)furo(3',2':4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,8,9,9a-hexahydro-8,9-dihydroxy-4-methoxy-, 8-m-chlorobenzoate, 2,3,6a,8,9,9a-Hexahydro-8,9-dihydroxy-4-methoxycyclopenta[c]furo[3 ,2 :4,5]furo[2,3-h][1]benzopyran-1,11-dione 8-(m-chlorobenzoate), 4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl 3-chlorobenzoate
| Molecular Formula | C24H17ClO9 |
|---|---|
| Molecular Weight | 484.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 484.05612 |
| Heavy Atoms | 34 |
| Complexity | 933.0 |
Chemical Identifiers
| CAS Number | 64267-66-9 |
|---|---|
| SMILES | COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C(C(OC5OC4=C1)OC(=O)C6=CC(=CC=C6)Cl)O |
| InChIKey | HMAJXTXGTZAYKC-UHFFFAOYSA-N |
Product Overview
DNCO (CAS 64267-66-9), with molecular formula C24H17ClO9 and molecular weight 484.06 g/mol. IUPAC: (4-hydroxy-11-methoxy-16,18-dioxo-6,8,19-trioxapentacyclo[10.7.0.02,9.03,7.013,17]nonadeca-1,9,11,13(17)-tetraen-5-yl) 3-chlorobenzoate.
Chemical Property Profile of DNCO
Property Insights of DNCO
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DNCO. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DNCO. Following Lipinski's Rule of Five, DNCO has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DNCO?
The CAS number of DNCO is 64267-66-9.
What is the molecular formula of DNCO?
The molecular formula of DNCO is C24H17ClO9.
What is the molecular weight of DNCO?
The molecular weight of DNCO is 484.06 g/mol.
Where can I buy DNCO?
You can request a quote for DNCO directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DNCO?
Yes, KEHONG BIO provides custom synthesis services for DNCO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.