(C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-
TL;DR: (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- (CAS 68258-80-0) is a chemical compound with molecular formula C21H35NO6 and molecular weight 397.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(aziridin-1-yl)ethyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate;2-methylpropyl 2-methylprop-2-enoate
Also Known As: (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-, 2-(1-Aziridinyl)ethyl methacrylate, isobutyl methacrylate, methyl methacrylate polymer, 2-Propenoic acid, 2-methyl-, 2-(1-aziridinyl)ethyl ester, polymer with methyl 2-methyl-2-propenoate and 2-methylpropyl 2-methyl-2-propenoate, 2-(aziridin-1-yl)ethyl 2-methylprop-2-enoate; methyl 2-methylprop-2-enoate; 2-methylpropyl 2-methylprop-2-enoate
| Molecular Formula | C21H35NO6 |
|---|---|
| Molecular Weight | 397.25 g/mol |
| LogP | 2.9185 |
| Topological Polar Surface Area | 81.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 397.24643 |
| Heavy Atoms | 28 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 68258-80-0 |
|---|---|
| SMILES | CC(C)COC(=O)C(=C)C.CC(=C)C(=O)OC.CC(=C)C(=O)OCCN1CC1 |
| InChIKey | JZDDLXDMECGPQB-UHFFFAOYSA-N |
Product Overview
(C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- (CAS 68258-80-0), with molecular formula C21H35NO6 and molecular weight 397.25 g/mol. IUPAC: 2-(aziridin-1-yl)ethyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate;2-methylpropyl 2-methylprop-2-enoate.
Chemical Property Profile of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-
Property Insights of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-
The XLogP value of 2.9185 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-. Following Lipinski's Rule of Five, (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-?
The CAS number of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- is 68258-80-0.
What is the molecular formula of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-?
The molecular formula of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- is C21H35NO6.
What is the molecular weight of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-?
The molecular weight of (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- is 397.25 g/mol.
Where can I buy (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-?
You can request a quote for (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H14-O2.C8-H13-N-O2.C5-H8-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.