1,1-Dimethyl-2-thiourea
TL;DR: 1,1-Dimethyl-2-thiourea (CAS 534-13-4) is a chemical compound with molecular formula C3H8N2S and molecular weight 104.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethylthiourea
Also Known As: N,N-Dimethylthiourea, 1,1-Dimethylthiourea, Thiourea, N,N-dimethyl-, 1,1-Dimethyl-2-thiourea, 1,1-dimethyl-thiourea
| Molecular Formula | C3H8N2S |
|---|---|
| Molecular Weight | 104.04 g/mol |
| LogP | -0.2084 |
| Topological Polar Surface Area | 29.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 104.04082 |
| Heavy Atoms | 6 |
| Complexity | 59.813538 |
Chemical Identifiers
| CAS Number | 534-13-4 |
|---|---|
| SMILES | CN(C)C(=S)N |
Product Overview
1,1-Dimethyl-2-thiourea (CAS 534-13-4), with molecular formula C3H8N2S and molecular weight 104.04 g/mol. IUPAC: 1,1-dimethylthiourea.
Chemical Property Profile of 1,1-Dimethyl-2-thiourea
Property Insights of 1,1-Dimethyl-2-thiourea
The XLogP value of -0.2084 indicates that 1,1-Dimethyl-2-thiourea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.26 Ų, 1,1-Dimethyl-2-thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethyl-2-thiourea has 1 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 1,1-Dimethyl-2-thiourea?
The CAS number of 1,1-Dimethyl-2-thiourea is 534-13-4.
What is the molecular formula of 1,1-Dimethyl-2-thiourea?
The molecular formula of 1,1-Dimethyl-2-thiourea is C3H8N2S.
What is the molecular weight of 1,1-Dimethyl-2-thiourea?
The molecular weight of 1,1-Dimethyl-2-thiourea is 104.04 g/mol.
Where can I buy 1,1-Dimethyl-2-thiourea?
You can request a quote for 1,1-Dimethyl-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethyl-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethyl-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.