RefChem:573936
TL;DR: RefChem:573936 (CAS 68391-53-7) is a chemical compound with molecular formula C39H66N2O8 and molecular weight 690.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-bis(prop-2-enoxymethyl)butyl N-[4-[[4-[2,2-bis(prop-2-enoxymethyl)butoxycarbonylamino]cyclohexyl]methyl]cyclohexyl]carbamate
Also Known As: Bis(2,2-bis((allyloxy)methyl)butyl) (methylenedi-4,1-cyclohexanediyl)dicarbamate, Carbamic acid, (methylenedi-4,1-cyclohexanediyl)bis-, bis(2,2-bis((2-propenyloxy)methyl)butyl) ester, Carbamic acid, N,N'-(methylenedi-4,1-cyclohexanediyl)bis-, C,C'-bis(2,2-bis((2-propen-1-yloxy)methyl)butyl) ester, bis{2,2-bis[(prop-2-en-1-yloxy)methyl]butyl}(methanediyldicyclohexane-4,1-diyl)biscarbamate, Carbamic acid, (methylenedi-4,1-cyclohexanediyl)bis-, bis[2,2-bis[(2-propenyloxy)methyl]butyl] ester
| Molecular Formula | C39H66N2O8 |
|---|---|
| Molecular Weight | 690.48 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 28 |
| Exact Mass | 690.48193 |
| Heavy Atoms | 49 |
| Complexity | 868.0 |
Chemical Identifiers
| CAS Number | 68391-53-7 |
|---|---|
| SMILES | CCC(COCC=C)(COCC=C)COC(=O)NC1CCC(CC1)CC2CCC(CC2)NC(=O)OCC(CC)(COCC=C)COCC=C |
| InChIKey | JHDHGEWZDLMHRO-UHFFFAOYSA-N |
Product Overview
RefChem:573936 (CAS 68391-53-7), with molecular formula C39H66N2O8 and molecular weight 690.48 g/mol. IUPAC: 2,2-bis(prop-2-enoxymethyl)butyl N-[4-[[4-[2,2-bis(prop-2-enoxymethyl)butoxycarbonylamino]cyclohexyl]methyl]cyclohexyl]carbamate.
Chemical Property Profile of RefChem:573936
Property Insights of RefChem:573936
The XLogP value of 7.3 indicates that RefChem:573936 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:573936. Following Lipinski's Rule of Five, RefChem:573936 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:573936?
The CAS number of RefChem:573936 is 68391-53-7.
What is the molecular formula of RefChem:573936?
The molecular formula of RefChem:573936 is C39H66N2O8.
What is the molecular weight of RefChem:573936?
The molecular weight of RefChem:573936 is 690.48 g/mol.
Where can I buy RefChem:573936?
You can request a quote for RefChem:573936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:573936?
Yes, KEHONG BIO provides custom synthesis services for RefChem:573936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.