1-oleoyl-2-hexanoyl-NBD-glycerol
TL;DR: 1-oleoyl-2-hexanoyl-NBD-glycerol (CAS 155581-64-9) is a chemical compound with molecular formula C33H52N4O8 and molecular weight 632.37854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-hydroxy-2-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoyloxy]propyl] (Z)-octadec-9-enoate
Also Known As: Nbd-DG, 1-Oleoyl-2-hexanoyl-nbd-glycerol, 1-Oleoyl-2-(6-(7-nitrobenzo-2-oxa-1,3-diazol-4-yl)hexanoyl)glycerol, [3-hydroxy-2-[6-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]hexanoyloxy]propyl] (Z)-octadec-9-enoate
Technical Specifications
| Molecular Formula | C33H52N4O8 |
| Molecular Weight | 632.37854 g/mol |
| XLogP | 8.6 |
| Topological Polar Surface Area (TPSA) | 170.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 28 |
| Exact Mass | 632.37854 Da |
| Heavy Atoms | 45 |
| Complexity | 840.0 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCNC1=CC=C(C2=NON=C12)[N+](=O)[O-] |
| InChIKey | OLPXOHBIRITKMO-KTKRTIGZSA-N |
Chemical Property Profile of 1-oleoyl-2-hexanoyl-NBD-glycerol
Property Insights of 1-oleoyl-2-hexanoyl-NBD-glycerol
The XLogP value of 8.6 indicates that 1-oleoyl-2-hexanoyl-NBD-glycerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 170.0 Ų indicates high polarity, suggesting 1-oleoyl-2-hexanoyl-NBD-glycerol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-oleoyl-2-hexanoyl-NBD-glycerol has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-oleoyl-2-hexanoyl-NBD-glycerol?
The CAS number of 1-oleoyl-2-hexanoyl-NBD-glycerol is 155581-64-9.
What is the molecular formula of 1-oleoyl-2-hexanoyl-NBD-glycerol?
The molecular formula of 1-oleoyl-2-hexanoyl-NBD-glycerol is C33H52N4O8.
What is the molecular weight of 1-oleoyl-2-hexanoyl-NBD-glycerol?
The molecular weight of 1-oleoyl-2-hexanoyl-NBD-glycerol is 632.37854 g/mol.
Where can I buy 1-oleoyl-2-hexanoyl-NBD-glycerol?
You can request a quote for 1-oleoyl-2-hexanoyl-NBD-glycerol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-oleoyl-2-hexanoyl-NBD-glycerol?
Yes, CoreyChem provides custom synthesis services for 1-oleoyl-2-hexanoyl-NBD-glycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.