2-Mercaptobenzophenone
TL;DR: 2-Mercaptobenzophenone (CAS 1801-99-6) is a chemical compound with molecular formula C13H10OS and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl-(2-sulfanylphenyl)methanone
Also Known As: 2-mercaptobenzophenone, 2-Mercapto-benzophenon, 2-benzoylbenzene-1-thiol, Phenyl-(2-sulfanylphenyl)methanone, phenyl(2-sulfanylphenyl)methanone
| Molecular Formula | C13H10OS |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 3.2063 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.04524 |
| Heavy Atoms | 15 |
| Complexity | 476.90445 |
Chemical Identifiers
| CAS Number | 1801-99-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2S |
Product Overview
2-Mercaptobenzophenone (CAS 1801-99-6), with molecular formula C13H10OS and molecular weight 214.05 g/mol. IUPAC: phenyl-(2-sulfanylphenyl)methanone.
Chemical Property Profile of 2-Mercaptobenzophenone
Property Insights of 2-Mercaptobenzophenone
The XLogP value of 3.2063 indicates that 2-Mercaptobenzophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Mercaptobenzophenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercaptobenzophenone 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 2-Mercaptobenzophenone?
The CAS number of 2-Mercaptobenzophenone is 1801-99-6.
What is the molecular formula of 2-Mercaptobenzophenone?
The molecular formula of 2-Mercaptobenzophenone is C13H10OS.
What is the molecular weight of 2-Mercaptobenzophenone?
The molecular weight of 2-Mercaptobenzophenone is 214.05 g/mol.
Where can I buy 2-Mercaptobenzophenone?
You can request a quote for 2-Mercaptobenzophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercaptobenzophenone?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercaptobenzophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.