1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-
TL;DR: 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- (CAS 227946-80-7) is a chemical compound with molecular formula C13H17ClO4 and molecular weight 272.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)hexan-1-one
Also Known As: 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-, J2.433.273J, 1-(3-CHLORO-2,4-DIHYDROXY-6-METHOXYPHENYL)HEXAN-1-ONE, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-1-hexanone, 1-(2,4-Dihydroxy-3-chloro-6-methoxyphenyl)hexane-1-one
| Molecular Formula | C13H17ClO4 |
|---|---|
| Molecular Weight | 272.08 g/mol |
| LogP | 3.5228 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.08154 |
| Heavy Atoms | 18 |
| Complexity | 443.10767 |
Chemical Identifiers
| CAS Number | 227946-80-7 |
|---|---|
| SMILES | CCCCCC(=O)C1=C(C=C(C(=C1O)Cl)O)OC |
Product Overview
1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- (CAS 227946-80-7), with molecular formula C13H17ClO4 and molecular weight 272.08 g/mol. IUPAC: 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)hexan-1-one.
Chemical Property Profile of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-
Property Insights of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-
The XLogP value of 3.5228 indicates that 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-. Following Lipinski's Rule of Five, 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- 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
Frequently Asked Questions
What is the CAS number of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-?
The CAS number of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- is 227946-80-7.
What is the molecular formula of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-?
The molecular formula of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- is C13H17ClO4.
What is the molecular weight of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-?
The molecular weight of 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- is 272.08 g/mol.
Where can I buy 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-?
You can request a quote for 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Hexanone, 1-(3-chloro-2,4-dihydroxy-6-methoxyphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.