2-Azidomethyl-1,3,3-trimethyl-cyclohexene
TL;DR: 2-Azidomethyl-1,3,3-trimethyl-cyclohexene (CAS 90073-44-2) is a chemical compound with molecular formula C10H17N3 and molecular weight 179.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(azidomethyl)-1,3,3-trimethylcyclohexene
Also Known As: 2-Azidomethyl-1,3,3-trimethyl-cyclohexene, 2-(azidomethyl)-1,3,3-trimethylcyclohexene, Cyclohexene, 2-(azidomethyl)-1,3,3-trimethyl-, 2-(AZIDOMETHYL)-1,3,3-TRIMETHYLCYCLOHEX-1-ENE
| Molecular Formula | C10H17N3 |
|---|---|
| Molecular Weight | 179.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 14.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.14224 |
| Heavy Atoms | 13 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 90073-44-2 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)CN=[N+]=[N-] |
| InChIKey | BSBAKFPAJYHJNA-UHFFFAOYSA-N |
Product Overview
2-Azidomethyl-1,3,3-trimethyl-cyclohexene (CAS 90073-44-2), with molecular formula C10H17N3 and molecular weight 179.14 g/mol. IUPAC: 2-(azidomethyl)-1,3,3-trimethylcyclohexene.
Chemical Property Profile of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene
Property Insights of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene
The XLogP value of 3.7 indicates that 2-Azidomethyl-1,3,3-trimethyl-cyclohexene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 14.4 Ų, 2-Azidomethyl-1,3,3-trimethyl-cyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Azidomethyl-1,3,3-trimethyl-cyclohexene 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 2-Azidomethyl-1,3,3-trimethyl-cyclohexene?
The CAS number of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene is 90073-44-2.
What is the molecular formula of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene?
The molecular formula of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene is C10H17N3.
What is the molecular weight of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene?
The molecular weight of 2-Azidomethyl-1,3,3-trimethyl-cyclohexene is 179.14 g/mol.
Where can I buy 2-Azidomethyl-1,3,3-trimethyl-cyclohexene?
You can request a quote for 2-Azidomethyl-1,3,3-trimethyl-cyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Azidomethyl-1,3,3-trimethyl-cyclohexene?
Yes, KEHONG BIO provides custom synthesis services for 2-Azidomethyl-1,3,3-trimethyl-cyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.