(2,3-Dimethylphenyl)thiourea
TL;DR: (2,3-Dimethylphenyl)thiourea (CAS 55754-05-7) is a chemical compound with molecular formula C9H12N2S and molecular weight 180.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3-dimethylphenyl)thiourea
Also Known As: 2,3-Dimethylphenylthiourea, (2,3-dimethylphenyl)thiourea, 1-(2,3-dimethylphenyl)thiourea, metaborothioic chloride, DIMETHYLPHENYLTHIOUREA
| Molecular Formula | C9H12N2S |
|---|---|
| Molecular Weight | 180.07 g/mol |
| LogP | 1.95894 |
| Topological Polar Surface Area | 38.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.07211 |
| Heavy Atoms | 12 |
| Complexity | 307.39688 |
Chemical Identifiers
| CAS Number | 55754-05-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=S)N)C |
Product Overview
(2,3-Dimethylphenyl)thiourea (CAS 55754-05-7), with molecular formula C9H12N2S and molecular weight 180.07 g/mol. IUPAC: (2,3-dimethylphenyl)thiourea.
Chemical Property Profile of (2,3-Dimethylphenyl)thiourea
Property Insights of (2,3-Dimethylphenyl)thiourea
The XLogP value of 1.95894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,3-Dimethylphenyl)thiourea. With a topological polar surface area (TPSA) of 38.05 Ų, (2,3-Dimethylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3-Dimethylphenyl)thiourea has 2 hydrogen bond donor(s) and 1 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 (2,3-Dimethylphenyl)thiourea?
The CAS number of (2,3-Dimethylphenyl)thiourea is 55754-05-7.
What is the molecular formula of (2,3-Dimethylphenyl)thiourea?
The molecular formula of (2,3-Dimethylphenyl)thiourea is C9H12N2S.
What is the molecular weight of (2,3-Dimethylphenyl)thiourea?
The molecular weight of (2,3-Dimethylphenyl)thiourea is 180.07 g/mol.
Where can I buy (2,3-Dimethylphenyl)thiourea?
You can request a quote for (2,3-Dimethylphenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3-Dimethylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (2,3-Dimethylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.