(C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-
TL;DR: (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- (CAS 42884-75-3) is a chemical compound with molecular formula C34H34N2O11 and molecular weight 646.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-aminophenyl)methyl]aniline;dimethyl benzene-1,4-dicarboxylate;1,3-dioxo-2-benzofuran-5-carboxylic acid;ethane-1,2-diol
Also Known As: (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-, Ethylene glycol, trimellitic anhydride, methylenedianiline, dimethylterephthalate polymer, 5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-, polymer with dimethyl 1,4-benzenedicarboxylate, 1,2-ethanediol and 4,4'-methylenebis[benzenamine], 4-[(4-aminophenyl)methyl]aniline; dimethyl benzene-1,4-dicarboxylate; 1,3-dioxo-2-benzofuran-5-carboxylic acid; ethane-1,2-diol, 5-Isobenzofurancarboxylic acid, 1,3-dihydro-1,3-dioxo-, polymer with 1,4-dimethyl 1,4-benzenedicarboxylate, 1,2-ethanediol and 4,4'-methylenebis(benzenamine)
| Molecular Formula | C34H34N2O11 |
|---|---|
| Molecular Weight | 646.22 g/mol |
| LogP | 3.368 |
| Topological Polar Surface Area | 226.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 646.21625 |
| Heavy Atoms | 47 |
| Complexity | 663.0 |
Chemical Identifiers
| CAS Number | 42884-75-3 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)OC.C1=CC(=CC=C1CC2=CC=C(C=C2)N)N.C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O.C(CO)O |
| InChIKey | DRLRUYQALRDTQD-UHFFFAOYSA-N |
Product Overview
(C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- (CAS 42884-75-3), with molecular formula C34H34N2O11 and molecular weight 646.22 g/mol. IUPAC: 4-[(4-aminophenyl)methyl]aniline;dimethyl benzene-1,4-dicarboxylate;1,3-dioxo-2-benzofuran-5-carboxylic acid;ethane-1,2-diol.
Chemical Property Profile of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-
Property Insights of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-
The XLogP value of 3.368 indicates that (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 226.0 Ų indicates high polarity, suggesting (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-?
The CAS number of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- is 42884-75-3.
What is the molecular formula of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-?
The molecular formula of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- is C34H34N2O11.
What is the molecular weight of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-?
The molecular weight of (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- is 646.22 g/mol.
Where can I buy (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-?
You can request a quote for (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C13-H14-N2.C10-H10-O4.C9-H4-O5.C2-H6-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.