RefChem:220308
TL;DR: RefChem:220308 (CAS 1973-95-1) is a chemical compound with molecular formula C26H46N2O4 and molecular weight 450.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine
Also Known As: 1,4-Cyclohexanebis(methylamine), N,N'-bis(1-cyclohexenylmethyl)-, diacetate, (E)-, trans-N,N'-(1,4-Cyclohexylenedimethylene)di(1-cyclohexenemethylamine) diacetate, trans-N,N'-Bis(1-cyclohexenylmethyl)-1,4-cyclohexanebis(methylamine) diacetate, 1-Cyclohexenemethylamine, N,N'-(1,4-cyclohexylenedimethylene)di-, diacetate, (E)-, cyclohexane-1,4-diylbis[n-(cyclohex-1-en-1-ylmethyl)methanamine] acetate(1:2)
| Molecular Formula | C26H46N2O4 |
|---|---|
| Molecular Weight | 450.35 g/mol |
| LogP | 5.15 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 450.34576 |
| Heavy Atoms | 32 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 1973-95-1 |
|---|---|
| SMILES | CC(=O)O.CC(=O)O.C1CCC(=CC1)CNCC2CCC(CC2)CNCC3=CCCCC3 |
| InChIKey | DFBQRUOKBUEDCF-UHFFFAOYSA-N |
Product Overview
RefChem:220308 (CAS 1973-95-1), with molecular formula C26H46N2O4 and molecular weight 450.35 g/mol. IUPAC: acetic acid;N-(cyclohexen-1-ylmethyl)-1-[4-[(cyclohexen-1-ylmethylamino)methyl]cyclohexyl]methanamine.
Chemical Property Profile of RefChem:220308
Property Insights of RefChem:220308
The XLogP value of 5.15 indicates that RefChem:220308 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:220308. Following Lipinski's Rule of Five, RefChem:220308 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:220308?
The CAS number of RefChem:220308 is 1973-95-1.
What is the molecular formula of RefChem:220308?
The molecular formula of RefChem:220308 is C26H46N2O4.
What is the molecular weight of RefChem:220308?
The molecular weight of RefChem:220308 is 450.35 g/mol.
Where can I buy RefChem:220308?
You can request a quote for RefChem:220308 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:220308?
Yes, KEHONG BIO provides custom synthesis services for RefChem:220308 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.