RefChem:319363
TL;DR: RefChem:319363 (CAS 72017-50-6) is a chemical compound with molecular formula C32H62Br2N2 and molecular weight 632.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]ethyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide
Also Known As: Ammonium, ethylenebis(1-methyl-3-(2,6,6-trimethyl-1-cyclohexen-1-yl)propyl)bis(dimethyl-, dibromide, hydrate, 2-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]ethyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide, AMMONIUM, ETHYLENEBIS(1-METHYL-3-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)PROPYL)BIS(D, 1,2-Ethanediaminium, N,N,N',N'-tetramethyl-N,N'-bis[1-methyl-3-(2,6,6-trimethyl-1-cyclohexen-1-yl)propyl]-, dibromide, monohydrate, N~1~,N~1~,N~2~,N~2~-Tetramethyl-N~1~,N~2~-bis[4-(2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-yl]ethane-1,2-bis(aminium) dibromide
| Molecular Formula | C32H62Br2N2 |
|---|---|
| Molecular Weight | 632.33 g/mol |
| LogP | 2.54 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 634.3259 |
| Heavy Atoms | 36 |
| Complexity | 683.0 |
Chemical Identifiers
| CAS Number | 72017-50-6 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)CCC(C)[N+](C)(C)CC[N+](C)(C)C(C)CCC2=C(CCCC2(C)C)C.[Br-].[Br-] |
| InChIKey | NZDNCUOTVXNZED-UHFFFAOYSA-L |
Product Overview
RefChem:319363 (CAS 72017-50-6), with molecular formula C32H62Br2N2 and molecular weight 632.33 g/mol. IUPAC: 2-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]ethyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide.
Chemical Property Profile of RefChem:319363
Property Insights of RefChem:319363
The XLogP value of 2.54 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319363. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:319363 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319363 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:319363?
The CAS number of RefChem:319363 is 72017-50-6.
What is the molecular formula of RefChem:319363?
The molecular formula of RefChem:319363 is C32H62Br2N2.
What is the molecular weight of RefChem:319363?
The molecular weight of RefChem:319363 is 632.33 g/mol.
Where can I buy RefChem:319363?
You can request a quote for RefChem:319363 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319363?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319363 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.