1,3-Dimethyl-5-(sulfinylamino)benzene
TL;DR: 1,3-Dimethyl-5-(sulfinylamino)benzene (CAS 39909-74-5) is a chemical compound with molecular formula C8H9NOS and molecular weight 167.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-(sulfinylamino)benzene
Also Known As: 1,3-dimethyl-5-(sulfinylamino)benzene, Benzenamine, 3,5-dimethyl-N-sulfinyl-, 3,5-Dimethyl-N-sulfinylbenzenamine, Benzenamine,3,5-dimethyl-N-sulfinyl, Benzenamine,3,5-dimethyl-N-sulfinyl-
| Molecular Formula | C8H9NOS |
|---|---|
| Molecular Weight | 167.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 30.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.04048 |
| Heavy Atoms | 11 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 39909-74-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N=S=O)C |
| InChIKey | ONXBUQKKSHZONJ-UHFFFAOYSA-N |
Product Overview
1,3-Dimethyl-5-(sulfinylamino)benzene (CAS 39909-74-5), with molecular formula C8H9NOS and molecular weight 167.04 g/mol. IUPAC: 1,3-dimethyl-5-(sulfinylamino)benzene.
Chemical Property Profile of 1,3-Dimethyl-5-(sulfinylamino)benzene
Property Insights of 1,3-Dimethyl-5-(sulfinylamino)benzene
The XLogP value of 3.2 indicates that 1,3-Dimethyl-5-(sulfinylamino)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.4 Ų, 1,3-Dimethyl-5-(sulfinylamino)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethyl-5-(sulfinylamino)benzene has 0 hydrogen bond donor(s) and 3 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 1,3-Dimethyl-5-(sulfinylamino)benzene?
The CAS number of 1,3-Dimethyl-5-(sulfinylamino)benzene is 39909-74-5.
What is the molecular formula of 1,3-Dimethyl-5-(sulfinylamino)benzene?
The molecular formula of 1,3-Dimethyl-5-(sulfinylamino)benzene is C8H9NOS.
What is the molecular weight of 1,3-Dimethyl-5-(sulfinylamino)benzene?
The molecular weight of 1,3-Dimethyl-5-(sulfinylamino)benzene is 167.04 g/mol.
Where can I buy 1,3-Dimethyl-5-(sulfinylamino)benzene?
You can request a quote for 1,3-Dimethyl-5-(sulfinylamino)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-5-(sulfinylamino)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-5-(sulfinylamino)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.