5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-
TL;DR: 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- (CAS 72575-50-9) is a chemical compound with molecular formula C20H23ClF3NO and molecular weight 385.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5S,7S)-N,N-dimethyl-5-[2-(trifluoromethyl)phenoxy]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine;hydrochloride
Also Known As: 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-, (5S,7S)-N,N-dimethyl-5-[2-(trifluoromethyl)phenoxy]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine hydrochloride, (5S,7S)-N,N-Dimethyl-5-[2-(trifluoromethyl)phenoxy]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine--hydrogen chloride (1/1), RefChem:305335
| Molecular Formula | C20H23ClF3NO |
|---|---|
| Molecular Weight | 385.14 g/mol |
| LogP | 5.5138 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.14203 |
| Heavy Atoms | 26 |
| Complexity | 732.9914 |
Chemical Identifiers
| CAS Number | 72575-50-9 |
|---|---|
| SMILES | CN(C)[C@H]1CCC2=CC=CC=C2[C@H](C1)OC3=CC=CC=C3C(F)(F)F.Cl |
Product Overview
5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- (CAS 72575-50-9), with molecular formula C20H23ClF3NO and molecular weight 385.14 g/mol. IUPAC: (5S,7S)-N,N-dimethyl-5-[2-(trifluoromethyl)phenoxy]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-7-amine;hydrochloride.
Chemical Property Profile of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-
Property Insights of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-
The XLogP value of 5.5138 indicates that 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.47 Ų, 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- 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 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-?
The CAS number of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- is 72575-50-9.
What is the molecular formula of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-?
The molecular formula of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- is C20H23ClF3NO.
What is the molecular weight of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-?
The molecular weight of 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- is 385.14 g/mol.
Where can I buy 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-?
You can request a quote for 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis-?
Yes, KEHONG BIO provides custom synthesis services for 5H-Benzocyclohepten-7-amine, 6,7,8,9-tetrahydro-N,N-dimethyl-5-(2-(trifluoromethyl)phenoxy)-,hydrochloride, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.