1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-
TL;DR: 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- (CAS 54862-34-9) is a chemical compound with molecular formula C17H26BrNO and molecular weight 339.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,9bS)-9b-butyl-3-methyl-2,3a,4,5-tetrahydro-1H-benzo[e]indol-8-ol;hydrobromide
Also Known As: 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-, trans-2,3,3a,4,5,9b-Hexahydro-9b-butyl-3-methyl-1H-benz(e)indol-8-ol hydrobromide, (3aS,9bS)-9b-butyl-3-methyl-2,3a,4,5-tetrahydro-1H-benzo[e]indol-8-ol hydrobromide, 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, cis-, (3aS,9bS)-9b-Butyl-3-methyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]indol-8-ol--hydrogen bromide (1/1)
| Molecular Formula | C17H26BrNO |
|---|---|
| Molecular Weight | 339.12 g/mol |
| LogP | 4.0484 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.11978 |
| Heavy Atoms | 20 |
| Complexity | 476.05786 |
Chemical Identifiers
| CAS Number | 54862-34-9 |
|---|---|
| SMILES | CCCC[C@@]12CCN([C@H]1CCC3=C2C=C(C=C3)O)C.Br |
Product Overview
1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- (CAS 54862-34-9), with molecular formula C17H26BrNO and molecular weight 339.12 g/mol. IUPAC: (3aS,9bS)-9b-butyl-3-methyl-2,3a,4,5-tetrahydro-1H-benzo[e]indol-8-ol;hydrobromide.
Chemical Property Profile of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-
Property Insights of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-
The XLogP value of 4.0484 indicates that 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- has 1 hydrogen bond donor(s) and 2 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 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-?
The CAS number of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- is 54862-34-9.
What is the molecular formula of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-?
The molecular formula of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- is C17H26BrNO.
What is the molecular weight of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-?
The molecular weight of 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- is 339.12 g/mol.
Where can I buy 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-?
You can request a quote for 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benz(e)indol-8-ol, 2,3,3a,4,5,9b-hexahydro-9b-butyl-3-methyl-, hydrobromide, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.