EINECS 275-006-1
TL;DR: EINECS 275-006-1 (CAS 70900-36-6) is a chemical compound with molecular formula C27H30F13N3O8S and molecular weight 803.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-methyl-5-[4-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]butoxycarbonylamino]phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate
Also Known As: EINECS 275-006-1, 2-((((2-Methyl-5-(((4-(methyl((tridecafluorohexyl)sulphonyl)amino)butoxy)carbonyl)amino)phenyl)amino)carbonyl)oxy)propyl methacrylate, 2-[[2-methyl-5-[4-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]butoxycarbonylamino]phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate, 2-Propenoic acid,2-methyl-,2-[[[[2-methyl-5-[[[4-[methyl[(tridecafluorohexyl)sulfonyl]amino]butoxy]carbonyl]amino]phenyl]amino]carbonyl]oxy]propylester (9CI), 2-[[[[2-Methyl-5-[[[4-[methyl[(tridecafluorohexyl)sulfonyl]amino]butoxy]carbonyl]amino]phenyl]amino]carbonyl]oxy]propyl-2-methylpropenoate
| Molecular Formula | C27H30F13N3O8S |
|---|---|
| Molecular Weight | 803.15 g/mol |
| LogP | 7.33792 |
| Topological Polar Surface Area | 140.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 803.1546 |
| Heavy Atoms | 52 |
| Complexity | 1588.6978 |
Chemical Identifiers
| CAS Number | 70900-36-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)OCCCCN(C)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)NC(=O)OC(C)COC(=O)C(=C)C |
Product Overview
EINECS 275-006-1 (CAS 70900-36-6), with molecular formula C27H30F13N3O8S and molecular weight 803.15 g/mol. IUPAC: 2-[[2-methyl-5-[4-[methyl(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]butoxycarbonylamino]phenyl]carbamoyloxy]propyl 2-methylprop-2-enoate.
Chemical Property Profile of EINECS 275-006-1
Property Insights of EINECS 275-006-1
The XLogP value of 7.33792 indicates that EINECS 275-006-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.34 Ų indicates high polarity, suggesting EINECS 275-006-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 275-006-1 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 EINECS 275-006-1?
The CAS number of EINECS 275-006-1 is 70900-36-6.
What is the molecular formula of EINECS 275-006-1?
The molecular formula of EINECS 275-006-1 is C27H30F13N3O8S.
What is the molecular weight of EINECS 275-006-1?
The molecular weight of EINECS 275-006-1 is 803.15 g/mol.
Where can I buy EINECS 275-006-1?
You can request a quote for EINECS 275-006-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 275-006-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 275-006-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.