(C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-
TL;DR: (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- (CAS 52496-38-5) is a chemical compound with molecular formula C37H54N2O12 and molecular weight 718.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butane-1,4-diol;hexanedioic acid;hexane-1,6-diol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one
Also Known As: (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-, 4,4'-Diphenylmethane diisocyanate, caprolactone, 1,6-hexanediol, 1,4-butanediol, adipic acid polymer, 4,4'-Diphenylmethanediisocyanate, epsilon-caprolactone, 1,6-hexanediol, 1,4-butanediol, adipic acid polymer, butane-1,4-diol; hexanedioic acid; hexane-1,6-diol; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene; oxepan-2-one, Hexanedioic acid, polymer with 1,4-butanediol, 1,6-hexanediol, 1,1'-methylenebis(4-isocyanatobenzene) and 2-oxepanone
| Molecular Formula | C37H54N2O12 |
|---|---|
| Molecular Weight | 718.37 g/mol |
| LogP | 5.3142 |
| Topological Polar Surface Area | 240.68 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 17 |
| Exact Mass | 718.3677 |
| Heavy Atoms | 51 |
| Complexity | 1161.8287 |
Chemical Identifiers
| CAS Number | 52496-38-5 |
|---|---|
| SMILES | C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCO)CCO.C(CCC(=O)O)CC(=O)O.C(CCO)CO |
Product Overview
(C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- (CAS 52496-38-5), with molecular formula C37H54N2O12 and molecular weight 718.37 g/mol. IUPAC: butane-1,4-diol;hexanedioic acid;hexane-1,6-diol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one.
Chemical Property Profile of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-
Property Insights of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-
The XLogP value of 5.3142 indicates that (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 240.68 Ų indicates high polarity, suggesting (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- has 6 hydrogen bond donor(s) and 12 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.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-?
The CAS number of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- is 52496-38-5.
What is the molecular formula of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-?
The molecular formula of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- is C37H54N2O12.
What is the molecular weight of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-?
The molecular weight of (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- is 718.37 g/mol.
Where can I buy (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-?
You can request a quote for (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-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.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C15-H10-N2-O2.C6-H14-O2.C6-H10-O4.C6-H10-O2.C4-H10-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.