C27H31NO2.1/2C2H2O4
TL;DR: C27H31NO2.1/2C2H2O4 (CAS 62099-07-4) is a chemical compound with molecular formula C56H64N2O8 and molecular weight 892.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(N-(2-benzhydryloxyethyl)-1-(2-prop-2-enylphenoxy)propan-2-amine);oxalic acid
Also Known As: C27H31NO2.1/2C2H2O4, C27-H31-N-O2.1/2C2-H2-O4, N-(2-(Diphenylmethoxy)ethyl)-1-(2-(2-propenyl)phenoxy)-2-propylamine hemioxalate, 2-Propylamine, N-(2-(diphenylmethoxy)ethyl)-1-(2-(2-propenyl)phenoxy)-, ethanedioate (2:1), N-(2-benzhydryloxyethyl)-1-(2-prop-2-enylphenoxy)propan-2-amine; oxalic acid
| Molecular Formula | C56H64N2O8 |
|---|---|
| Molecular Weight | 892.47 g/mol |
| LogP | 10.312 |
| Topological Polar Surface Area | 135.58 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 24 |
| Exact Mass | 892.46625 |
| Heavy Atoms | 66 |
| Complexity | 2034.4143 |
Chemical Identifiers
| CAS Number | 62099-07-4 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1CC=C)NCCOC(C2=CC=CC=C2)C3=CC=CC=C3.CC(COC1=CC=CC=C1CC=C)NCCOC(C2=CC=CC=C2)C3=CC=CC=C3.C(=O)(C(=O)O)O |
Product Overview
C27H31NO2.1/2C2H2O4 (CAS 62099-07-4), with molecular formula C56H64N2O8 and molecular weight 892.47 g/mol. IUPAC: bis(N-(2-benzhydryloxyethyl)-1-(2-prop-2-enylphenoxy)propan-2-amine);oxalic acid.
Chemical Property Profile of C27H31NO2.1/2C2H2O4
Property Insights of C27H31NO2.1/2C2H2O4
The XLogP value of 10.312 indicates that C27H31NO2.1/2C2H2O4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.58 Ų falls within the moderate polarity range, balancing permeability and solubility for C27H31NO2.1/2C2H2O4. Following Lipinski's Rule of Five, C27H31NO2.1/2C2H2O4 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C27H31NO2.1/2C2H2O4?
The CAS number of C27H31NO2.1/2C2H2O4 is 62099-07-4.
What is the molecular formula of C27H31NO2.1/2C2H2O4?
The molecular formula of C27H31NO2.1/2C2H2O4 is C56H64N2O8.
What is the molecular weight of C27H31NO2.1/2C2H2O4?
The molecular weight of C27H31NO2.1/2C2H2O4 is 892.47 g/mol.
Where can I buy C27H31NO2.1/2C2H2O4?
You can request a quote for C27H31NO2.1/2C2H2O4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C27H31NO2.1/2C2H2O4?
Yes, KEHONG BIO provides custom synthesis services for C27H31NO2.1/2C2H2O4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.