![2-[2-(Aminomethyl)phenyl]sulfanylphenol structure](/static/products/127/127906-43-8.webp)
2-[2-(Aminomethyl)phenyl]sulfanylphenol
TL;DR: 2-[2-(Aminomethyl)phenyl]sulfanylphenol (CAS 127906-43-8) is a chemical compound with molecular formula C13H13NOS and molecular weight 231.0718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(aminomethyl)phenyl]sulfanylphenol
Also Known As: 2-[2-(aminomethyl)phenyl]sulfanylphenol, 2-{[2-(aminomethyl)phenyl]sulfanyl}phenol, AE-641/00358058, AE-641/30177002
Technical Specifications
| Molecular Formula | C13H13NOS |
| Molecular Weight | 231.0718 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.0718 Da |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
| SMILES | C1=CC=C(C(=C1)CN)SC2=CC=CC=C2O |
| InChIKey | QCRMQPHVKNZXCM-UHFFFAOYSA-N |
Chemical Property Profile of 2-[2-(Aminomethyl)phenyl]sulfanylphenol
Property Insights of 2-[2-(Aminomethyl)phenyl]sulfanylphenol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(Aminomethyl)phenyl]sulfanylphenol. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(Aminomethyl)phenyl]sulfanylphenol. Following Lipinski's Rule of Five, 2-[2-(Aminomethyl)phenyl]sulfanylphenol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[2-(Aminomethyl)phenyl]sulfanylphenol?
The CAS number of 2-[2-(Aminomethyl)phenyl]sulfanylphenol is 127906-43-8.
What is the molecular formula of 2-[2-(Aminomethyl)phenyl]sulfanylphenol?
The molecular formula of 2-[2-(Aminomethyl)phenyl]sulfanylphenol is C13H13NOS.
What is the molecular weight of 2-[2-(Aminomethyl)phenyl]sulfanylphenol?
The molecular weight of 2-[2-(Aminomethyl)phenyl]sulfanylphenol is 231.0718 g/mol.
Where can I buy 2-[2-(Aminomethyl)phenyl]sulfanylphenol?
You can request a quote for 2-[2-(Aminomethyl)phenyl]sulfanylphenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[2-(Aminomethyl)phenyl]sulfanylphenol?
Yes, CoreyChem provides custom synthesis services for 2-[2-(Aminomethyl)phenyl]sulfanylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.