![[(3-Methylbenzyl)sulfanyl]acetic acid structure](/static/products/3472/34722-35-5.webp)
[(3-Methylbenzyl)sulfanyl]acetic acid
TL;DR: [(3-Methylbenzyl)sulfanyl]acetic acid (CAS 34722-35-5) is a chemical compound with molecular formula C10H12O2S and molecular weight 196.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methylphenyl)methylsulfanyl]acetic acid
Also Known As: [(3-methylbenzyl)thio]acetic acid|[(3-methylbenzyl)sulfanyl]acetic acid|2-((3-Methylbenzyl)thio)acetic acid|2-{[(3-methylphenyl)methyl]sulfanyl}acetic acid|2-(m-Tolylmethylsulfanyl)acetic acid|(3-Methylbenzylthio)essigsaeure|(3-Chlor-benzylthio)-essigsaeure|(3-METHYLBENZYL)THIO]ACETIC ACID|2-((3-Methylbenzyl)thio)aceticacid|2-[(3-methylphenyl)methylsulfanyl]acetic Acid|NCGC00339498-01|MFCD05263737|EN300-09087
| Molecular Formula | C10H12O2S |
|---|---|
| Molecular Weight | 196.06 g/mol |
| LogP | 2.31282 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.0558 |
| Heavy Atoms | 13 |
| Complexity | 296.73114 |
Chemical Identifiers
| CAS Number | 34722-35-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CSCC(=O)O |
Product Overview
[(3-Methylbenzyl)sulfanyl]acetic acid (CAS 34722-35-5), with molecular formula C10H12O2S and molecular weight 196.06 g/mol. IUPAC: 2-[(3-methylphenyl)methylsulfanyl]acetic acid.
Chemical Property Profile of [(3-Methylbenzyl)sulfanyl]acetic acid
Property Insights of [(3-Methylbenzyl)sulfanyl]acetic acid
The XLogP value of 2.31282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3-Methylbenzyl)sulfanyl]acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, [(3-Methylbenzyl)sulfanyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3-Methylbenzyl)sulfanyl]acetic acid has 1 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 [(3-Methylbenzyl)sulfanyl]acetic acid?
The CAS number of [(3-Methylbenzyl)sulfanyl]acetic acid is 34722-35-5.
What is the molecular formula of [(3-Methylbenzyl)sulfanyl]acetic acid?
The molecular formula of [(3-Methylbenzyl)sulfanyl]acetic acid is C10H12O2S.
What is the molecular weight of [(3-Methylbenzyl)sulfanyl]acetic acid?
The molecular weight of [(3-Methylbenzyl)sulfanyl]acetic acid is 196.06 g/mol.
Where can I buy [(3-Methylbenzyl)sulfanyl]acetic acid?
You can request a quote for [(3-Methylbenzyl)sulfanyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3-Methylbenzyl)sulfanyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(3-Methylbenzyl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.