2-Aza-2,3-dihydrosqualene N-oxide
TL;DR: 2-Aza-2,3-dihydrosqualene N-oxide (CAS 100692-44-2) is a chemical compound with molecular formula C29H51NO and molecular weight 429.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E,8E,12E,16E)-N,N,4,8,13,17,21-heptamethyldocosa-4,8,12,16,20-pentaen-1-amine oxide
Also Known As: 2-Aza-2,3-dihydrosqualene N-oxide, (4E,8E,12E,16E)-N,N,4,8,13,17,21-heptamethyldocosa-4,8,12,16,20-pentaen-1-amine oxide, (4E,8E,12E,16E)-N,N,4,8,13,17,21-HEPTAMETHYLDOCOSA-4,8,12,16,20-PENTAENAMINE OXIDE, (4E,8E,12E,16E)-N,N,4,8,13,17,21-Heptamethyldocosa-4,8,12,16,20-penten-1-amine N-oxide, 2H-Benz[e]isoindole,5a,6,7,8,9,9a-hexahydro-6,6,9a-trimethyl-2-(1-methyl-2-phenylethyl)-,[5aS-[2(S*),5aa,9ab]]-
| Molecular Formula | C29H51NO |
|---|---|
| Molecular Weight | 429.40 g/mol |
| LogP | 9.213 |
| Topological Polar Surface Area | 23.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 16 |
| Exact Mass | 429.39706 |
| Heavy Atoms | 31 |
| Complexity | 634.1383 |
Chemical Identifiers
| CAS Number | 100692-44-2 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/CC/C=C(\C)/CC/C=C(\C)/CCC[N+](C)(C)[O-])/C)/C)C |
Product Overview
2-Aza-2,3-dihydrosqualene N-oxide (CAS 100692-44-2), with molecular formula C29H51NO and molecular weight 429.40 g/mol. IUPAC: (4E,8E,12E,16E)-N,N,4,8,13,17,21-heptamethyldocosa-4,8,12,16,20-pentaen-1-amine oxide.
Chemical Property Profile of 2-Aza-2,3-dihydrosqualene N-oxide
Property Insights of 2-Aza-2,3-dihydrosqualene N-oxide
The XLogP value of 9.213 indicates that 2-Aza-2,3-dihydrosqualene N-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.06 Ų, 2-Aza-2,3-dihydrosqualene N-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Aza-2,3-dihydrosqualene N-oxide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Aza-2,3-dihydrosqualene N-oxide?
The CAS number of 2-Aza-2,3-dihydrosqualene N-oxide is 100692-44-2.
What is the molecular formula of 2-Aza-2,3-dihydrosqualene N-oxide?
The molecular formula of 2-Aza-2,3-dihydrosqualene N-oxide is C29H51NO.
What is the molecular weight of 2-Aza-2,3-dihydrosqualene N-oxide?
The molecular weight of 2-Aza-2,3-dihydrosqualene N-oxide is 429.40 g/mol.
Where can I buy 2-Aza-2,3-dihydrosqualene N-oxide?
You can request a quote for 2-Aza-2,3-dihydrosqualene N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aza-2,3-dihydrosqualene N-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Aza-2,3-dihydrosqualene N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.