(C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-
TL;DR: (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- (CAS 53794-87-9) is a chemical compound with molecular formula C31H34N2O8 and molecular weight 562.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-hydroxyethoxy)phenoxy]ethanol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one
Also Known As: (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-, 2-[4-(2-hydroxyethoxy)phenoxy]ethanol; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene; oxepan-2-one, 2-[4-(2-hydroxyethoxy)phenoxy]ethanol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one, 2-Oxepanone, polymer with 1,1'-methylenebis(4-isocyanatobenzene) and 2,2'-(1,4-phenylenebis(oxy))bis(ethanol), 2-Oxepanone, polymer with 1,1'-methylenebis[4-isocyanatobenzene] and 2,2'-[1,4-phenylenebis(oxy)]bis[ethanol]
| Molecular Formula | C31H34N2O8 |
|---|---|
| Molecular Weight | 562.23 g/mol |
| LogP | 4.7444 |
| Topological Polar Surface Area | 144.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 562.2315 |
| Heavy Atoms | 41 |
| Complexity | 1152.2852 |
Chemical Identifiers
| CAS Number | 53794-87-9 |
|---|---|
| SMILES | C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C1=CC(=CC=C1OCCO)OCCO |
Product Overview
(C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- (CAS 53794-87-9), with molecular formula C31H34N2O8 and molecular weight 562.23 g/mol. IUPAC: 2-[4-(2-hydroxyethoxy)phenoxy]ethanol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one.
Chemical Property Profile of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-
Property Insights of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-
The XLogP value of 4.7444 indicates that (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.08 Ų indicates high polarity, suggesting (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-?
The CAS number of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- is 53794-87-9.
What is the molecular formula of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-?
The molecular formula of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- is C31H34N2O8.
What is the molecular weight of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-?
The molecular weight of (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- is 562.23 g/mol.
Where can I buy (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-?
You can request a quote for (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C15-H10-N2-O2.C10-H14-O4.C6-H10-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.