RefChem:1066631
TL;DR: RefChem:1066631 (CAS 13088-00-1) is a chemical compound with molecular formula C22H30ClNO and molecular weight 359.2016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,3-dimethyl-1-phenyl-2-benzofuran-1-yl)-N,N,2-trimethylpropan-1-amine;hydrochloride
Also Known As: LU 3-048, 1-Phthalanpropylamine, beta,N,N,3,3-pentamethyl-1-phenyl-, hydrochloride, Phthalan, 3,3-dimethyl-1-(3-dimethylamino-2-methylpropyl)-1-phenyl-, hydrochloride, 3-(3,3-dimethyl-1-phenyl-1,3-dihydro-2-benzofuran-1-yl)-n,n,2-trimethylpropan-1-amine hydrochloride(1:1), 3-(3,3-Dimethyl-1-phenyl-1,3-dihydro-2-benzofuran-1-yl)-N,N,2-trimethylpropan-1-amine--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C22H30ClNO |
| Molecular Weight | 359.2016 g/mol |
| XLogP | 5.21 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.2016 Da |
| Heavy Atoms | 25 |
| Complexity | 412.0 |
| SMILES | CC(CC1(C2=CC=CC=C2C(O1)(C)C)C3=CC=CC=C3)CN(C)C.Cl |
| InChIKey | ZQMBKJWVFPOZHQ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1066631
Property Insights of RefChem:1066631
The XLogP value of 5.21 indicates that RefChem:1066631 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, RefChem:1066631 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1066631 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1066631?
The CAS number of RefChem:1066631 is 13088-00-1.
What is the molecular formula of RefChem:1066631?
The molecular formula of RefChem:1066631 is C22H30ClNO.
What is the molecular weight of RefChem:1066631?
The molecular weight of RefChem:1066631 is 359.2016 g/mol.
Where can I buy RefChem:1066631?
You can request a quote for RefChem:1066631 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1066631?
Yes, CoreyChem provides custom synthesis services for RefChem:1066631 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.