4-Methoxy-2-methylbenzenecarbothialdehyde
TL;DR: 4-Methoxy-2-methylbenzenecarbothialdehyde (CAS 887572-27-2) is a chemical compound with molecular formula C9H10OS and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2-methylthiobenzaldehyde
Also Known As: 4-methoxy-2-methylbenzenecarbothialdehyde, 4-methoxy-2-methylthiobenzaldehyde, 4-Methoxy-2-methylbenzothialdehyde, (4-methoxy-2-methylphenyl)methanethial, 4-methoxy-2-methylbenzene-1-carbothialdehyde
| Molecular Formula | C9H10OS |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 2.35142 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.04524 |
| Heavy Atoms | 11 |
| Complexity | 268.2653 |
Chemical Identifiers
| CAS Number | 887572-27-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC)C=S |
Product Overview
4-Methoxy-2-methylbenzenecarbothialdehyde (CAS 887572-27-2), with molecular formula C9H10OS and molecular weight 166.05 g/mol. IUPAC: 4-methoxy-2-methylthiobenzaldehyde.
Chemical Property Profile of 4-Methoxy-2-methylbenzenecarbothialdehyde
Property Insights of 4-Methoxy-2-methylbenzenecarbothialdehyde
The XLogP value of 2.35142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-2-methylbenzenecarbothialdehyde. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Methoxy-2-methylbenzenecarbothialdehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-2-methylbenzenecarbothialdehyde has 0 hydrogen bond donor(s) and 2 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 4-Methoxy-2-methylbenzenecarbothialdehyde?
The CAS number of 4-Methoxy-2-methylbenzenecarbothialdehyde is 887572-27-2.
What is the molecular formula of 4-Methoxy-2-methylbenzenecarbothialdehyde?
The molecular formula of 4-Methoxy-2-methylbenzenecarbothialdehyde is C9H10OS.
What is the molecular weight of 4-Methoxy-2-methylbenzenecarbothialdehyde?
The molecular weight of 4-Methoxy-2-methylbenzenecarbothialdehyde is 166.05 g/mol.
Where can I buy 4-Methoxy-2-methylbenzenecarbothialdehyde?
You can request a quote for 4-Methoxy-2-methylbenzenecarbothialdehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2-methylbenzenecarbothialdehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2-methylbenzenecarbothialdehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.