3,3-Dimethyldiazirine
TL;DR: 3,3-Dimethyldiazirine (CAS 5161-49-9) is a chemical compound with molecular formula C3H6N2 and molecular weight 70.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyldiazirine
Also Known As: 3,3-Dimethyldiazirine, dimethyldiazirine, dimethyl-3H-diazirine, 3,3-Dimethyl-3H-diazirine, 3,3-Dimethyl-3H-diazirene
| Molecular Formula | C3H6N2 |
|---|---|
| Molecular Weight | 70.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 70.0531 |
| Heavy Atoms | 5 |
| Complexity | 65.0 |
Chemical Identifiers
| CAS Number | 5161-49-9 |
|---|---|
| SMILES | CC1(N=N1)C |
| InChIKey | JYSCQQRNTHDPBR-UHFFFAOYSA-N |
Product Overview
3,3-Dimethyldiazirine (CAS 5161-49-9), with molecular formula C3H6N2 and molecular weight 70.05 g/mol. IUPAC: 3,3-dimethyldiazirine.
Chemical Property Profile of 3,3-Dimethyldiazirine
Property Insights of 3,3-Dimethyldiazirine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyldiazirine. With a topological polar surface area (TPSA) of 24.7 Ų, 3,3-Dimethyldiazirine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyldiazirine has 0 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 3,3-Dimethyldiazirine?
The CAS number of 3,3-Dimethyldiazirine is 5161-49-9.
What is the molecular formula of 3,3-Dimethyldiazirine?
The molecular formula of 3,3-Dimethyldiazirine is C3H6N2.
What is the molecular weight of 3,3-Dimethyldiazirine?
The molecular weight of 3,3-Dimethyldiazirine is 70.05 g/mol.
Where can I buy 3,3-Dimethyldiazirine?
You can request a quote for 3,3-Dimethyldiazirine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyldiazirine?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyldiazirine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.