2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-
TL;DR: 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- (CAS 2701-91-9) is a chemical compound with molecular formula C13H9Cl2NO2 and molecular weight 281.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methylcyclohexa-2,5-dien-1-one
Also Known As: 2,6-Dichlorophenol-indo-o-cresol Sodium Salt, 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methylcyclohexa-2,5-dien-1-one
| Molecular Formula | C13H9Cl2NO2 |
|---|---|
| Molecular Weight | 281.00 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.00104 |
| Heavy Atoms | 18 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 2701-91-9 |
|---|---|
| SMILES | CC1=CC(=NC2=CC(=C(C(=C2)Cl)O)Cl)C=CC1=O |
| InChIKey | TXAHKWWRNYZPFN-UHFFFAOYSA-N |
Product Overview
2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- (CAS 2701-91-9), with molecular formula C13H9Cl2NO2 and molecular weight 281.00 g/mol. IUPAC: 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methylcyclohexa-2,5-dien-1-one.
Chemical Property Profile of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-
Property Insights of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-
The XLogP value of 3.1 indicates that 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- has 1 hydrogen bond donor(s) and 3 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 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-?
The CAS number of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- is 2701-91-9.
What is the molecular formula of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-?
The molecular formula of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- is C13H9Cl2NO2.
What is the molecular weight of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-?
The molecular weight of 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- is 281.00 g/mol.
Where can I buy 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-?
You can request a quote for 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Cyclohexadien-1-one, 4-(3,5-dichloro-4-hydroxyphenyl)imino-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.