RefChem:77297
TL;DR: RefChem:77297 (CAS 6427-98-1) is a chemical compound with molecular formula C46H98NO4P and molecular weight 759.72 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyloctadecan-1-amine;ditridecyl hydrogen phosphate
Also Known As: Octadecyl(dimethyl)ammonium ditridecyl phosphate, n,n-dimethyloctadecan-1-aminium ditridecyl phosphate, 1-Tridecanol, hydrogen phosphate, compd. with N,N-dimethyloctadecylamine (1:1), N,N-dimethyloctadecan-1-amine; ditridecyl hydrogen phosphate, 1-Tridecanol, 1-(hydrogen phosphate), compd. with N,N-dimethyl-1-octadecanamine (1:1)
| Molecular Formula | C46H98NO4P |
|---|---|
| Molecular Weight | 759.72 g/mol |
| LogP | 16.55 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 43 |
| Exact Mass | 759.7233 |
| Heavy Atoms | 52 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 6427-98-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCN(C)C.CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC |
| InChIKey | UICHMASMHUXHBX-UHFFFAOYSA-N |
Product Overview
RefChem:77297 (CAS 6427-98-1), with molecular formula C46H98NO4P and molecular weight 759.72 g/mol. IUPAC: N,N-dimethyloctadecan-1-amine;ditridecyl hydrogen phosphate.
Chemical Property Profile of RefChem:77297
Property Insights of RefChem:77297
The XLogP value of 16.55 indicates that RefChem:77297 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.0 Ų, RefChem:77297 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:77297 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:77297?
The CAS number of RefChem:77297 is 6427-98-1.
What is the molecular formula of RefChem:77297?
The molecular formula of RefChem:77297 is C46H98NO4P.
What is the molecular weight of RefChem:77297?
The molecular weight of RefChem:77297 is 759.72 g/mol.
Where can I buy RefChem:77297?
You can request a quote for RefChem:77297 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:77297?
Yes, KEHONG BIO provides custom synthesis services for RefChem:77297 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.