![Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone structure](/static/products/9632/96328-91-5.webp)
Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone
TL;DR: Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone (CAS 96328-91-5) is a chemical compound with molecular formula C63H92Cl2N4O14 and molecular weight 1198.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butane-1,4-diol;carbonyl dichloride;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol;4-[[4-hydroxy-2,6-di(propan-2-yl)phenyl]iminomethylideneamino]-3,5-di(propan-2-yl)phenol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one
Also Known As: Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone, (C25-H34-N2-O2.C15-H10-N2-O2.C6-H14-O3.C6-H14-O2.C6-H10-O2.C4-H10-O2.C-Cl2-O)x-, butane-1,4-diol; carbonyl dichloride; 2-ethyl-2-(hydroxymethyl)propane-1,3-diol; hexane-1,6-diol; 4-[[4-hydroxy-2,6-di(propan-2-yl)phenyl]iminomethylideneamino]-3,5-di(propan-2-yl)phenol; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene; oxepan-2-one, Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis(3,5-bis(1-methylethyl)phenol), 1,1'-methylenebis(4-isocyanatobenzene) and 2-oxepanone
| Molecular Formula | C63H92Cl2N4O14 |
|---|---|
| Molecular Weight | 1198.60 g/mol |
| LogP | 13.2704 |
| Topological Polar Surface Area | 309.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 22 |
| Exact Mass | 1198.5988 |
| Heavy Atoms | 83 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 96328-91-5 |
|---|---|
| SMILES | CCC(CO)(CO)CO.CC(C)C1=CC(=CC(=C1N=C=NC2=C(C=C(C=C2C(C)C)O)C(C)C)C(C)C)O.C1CCC(=O)OCC1.C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCCO)CCO.C(CCO)CO.C(=O)(Cl)Cl |
| InChIKey | FOIGSOXSSHXCGI-UHFFFAOYSA-N |
Product Overview
Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone (CAS 96328-91-5), with molecular formula C63H92Cl2N4O14 and molecular weight 1198.60 g/mol. IUPAC: butane-1,4-diol;carbonyl dichloride;2-ethyl-2-(hydroxymethyl)propane-1,3-diol;hexane-1,6-diol;4-[[4-hydroxy-2,6-di(propan-2-yl)phenyl]iminomethylideneamino]-3,5-di(propan-2-yl)phenol;1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene;oxepan-2-one.
Chemical Property Profile of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone
Property Insights of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone
The XLogP value of 13.2704 indicates that Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 309.0 Ų indicates high polarity, suggesting Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone has 9 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone?
The CAS number of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone is 96328-91-5.
What is the molecular formula of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone?
The molecular formula of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone is C63H92Cl2N4O14.
What is the molecular weight of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone?
The molecular weight of Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone is 1198.60 g/mol.
Where can I buy Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone?
You can request a quote for Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone?
Yes, KEHONG BIO provides custom synthesis services for Carbonic dichloride, polymer with 1,4-butanediol, 2-ethyl-2-(hydroxymethyl)-1,3-propanediol, 1,6-hexanediol, 4,4'-(methanetetrayldinitrilo)bis[3,5-bis(1-methylethyl)phenol], 1,1'-methylenebis[4-isocyanatobenzene] and 2-oxepanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.