Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)
TL;DR: Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) (CAS 51490-53-0) is a chemical compound with molecular formula C27H35NO5 and molecular weight 453.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethoxy]ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1), ETHANAMINE, N,N-DIMETHYL-2-(1-PHENYL-1-(6,7,8,9-TETRAHYDRO-5H-BENZOCYCLOHEPTEN-2, dimethyl-[2-[1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethoxy]ethyl]azanium; (Z)-4-hydroxy-4-oxobut-2-enoate, RefChem:1084309
| Molecular Formula | C27H35NO5 |
|---|---|
| Molecular Weight | 453.25 g/mol |
| LogP | 1.7572 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.25153 |
| Heavy Atoms | 33 |
| Complexity | 922.78284 |
Chemical Identifiers
| CAS Number | 51490-53-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)(C2=CC3=C(CCCCC3)C=C2)OCC[NH+](C)C.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) (CAS 51490-53-0), with molecular formula C27H35NO5 and molecular weight 453.25 g/mol. IUPAC: dimethyl-[2-[1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)ethoxy]ethyl]azanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)
Property Insights of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)
The XLogP value of 1.7572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1). The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1). Following Lipinski's Rule of Five, Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The CAS number of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) is 51490-53-0.
What is the molecular formula of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The molecular formula of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) is C27H35NO5.
What is the molecular weight of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)?
The molecular weight of Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) is 453.25 g/mol.
Where can I buy Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)?
You can request a quote for Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Ethanamine, N,N-dimethyl-2-(1-phenyl-1-(6,7,8,9-tetrahydro-5H-benzocyclohepten-2-yl)ethoxy)-, (Z)-2-butenedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.