1,1-Di(propan-2-yl)guanidine
TL;DR: 1,1-Di(propan-2-yl)guanidine (CAS 104919-92-8) is a chemical compound with molecular formula C7H17N3 and molecular weight 143.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-di(propan-2-yl)guanidine
Also Known As: 1,1-diisopropylguanidine, 1,1-di(propan-2-yl)guanidine, Diisopropylguanidine, N,N-DI-ISO-PROPYL-GUANIDINE, 1,1-dipropan-2-ylguanidine
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H17N3 |
| Molecular Weight | 143.14224 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 143.14224 Da |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
| SMILES | CC(C)N(C(C)C)C(=N)N |
| InChIKey | WPAUGFDCXHHMCR-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Di(propan-2-yl)guanidine
Property Insights of 1,1-Di(propan-2-yl)guanidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1-Di(propan-2-yl)guanidine. With a topological polar surface area (TPSA) of 53.1 Ų, 1,1-Di(propan-2-yl)guanidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Di(propan-2-yl)guanidine 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
What is the CAS number of 1,1-Di(propan-2-yl)guanidine?
The CAS number of 1,1-Di(propan-2-yl)guanidine is 104919-92-8.
What is the molecular formula of 1,1-Di(propan-2-yl)guanidine?
The molecular formula of 1,1-Di(propan-2-yl)guanidine is C7H17N3.
What is the molecular weight of 1,1-Di(propan-2-yl)guanidine?
The molecular weight of 1,1-Di(propan-2-yl)guanidine is 143.14224 g/mol.
Where can I buy 1,1-Di(propan-2-yl)guanidine?
You can request a quote for 1,1-Di(propan-2-yl)guanidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Di(propan-2-yl)guanidine?
Yes, CoreyChem provides custom synthesis services for 1,1-Di(propan-2-yl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.