Methyl 4-hydroxy-2-methoxybenzenecarbodithioate
TL;DR: Methyl 4-hydroxy-2-methoxybenzenecarbodithioate (CAS 62070-80-8) is a chemical compound with molecular formula C9H10O2S2 and molecular weight 214.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-hydroxy-2-methoxybenzenecarbodithioate
Also Known As: methyl 4-hydroxy-2-methoxybenzenecarbodithioate, 3-methoxy-4-[methylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one, (4Z)-3-Methoxy-4-[(methylsulfanyl)(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C9H10O2S2 |
|---|---|
| Molecular Weight | 214.01 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.01222 |
| Heavy Atoms | 13 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 62070-80-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)O)C(=S)SC |
| InChIKey | FZFAKKZFYSCZEJ-UHFFFAOYSA-N |
Product Overview
Methyl 4-hydroxy-2-methoxybenzenecarbodithioate (CAS 62070-80-8), with molecular formula C9H10O2S2 and molecular weight 214.01 g/mol. IUPAC: methyl 4-hydroxy-2-methoxybenzenecarbodithioate.
Chemical Property Profile of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate
Property Insights of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-hydroxy-2-methoxybenzenecarbodithioate. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-hydroxy-2-methoxybenzenecarbodithioate. Following Lipinski's Rule of Five, Methyl 4-hydroxy-2-methoxybenzenecarbodithioate has 1 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 Methyl 4-hydroxy-2-methoxybenzenecarbodithioate?
The CAS number of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate is 62070-80-8.
What is the molecular formula of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate?
The molecular formula of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate is C9H10O2S2.
What is the molecular weight of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate?
The molecular weight of Methyl 4-hydroxy-2-methoxybenzenecarbodithioate is 214.01 g/mol.
Where can I buy Methyl 4-hydroxy-2-methoxybenzenecarbodithioate?
You can request a quote for Methyl 4-hydroxy-2-methoxybenzenecarbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-hydroxy-2-methoxybenzenecarbodithioate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-hydroxy-2-methoxybenzenecarbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.