1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-
TL;DR: 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- (CAS 33494-18-7) is a chemical compound with molecular formula C12H17N and molecular weight 175.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,4,5,6-tetrahydro-2H-1-benzazocine
Also Known As: 1-methyl-1,2,3,4,5,6-hexahydro-1-benzazocine, 1-methyl-3,4,5,6-tetrahydro-2H-1-benzazocine, 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-, J3.461.215C, 1-Methyl-1,2,3,4,5,6-hexahydro-1-benzoazocine
| Molecular Formula | C12H17N |
|---|---|
| Molecular Weight | 175.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.1361 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 33494-18-7 |
|---|---|
| SMILES | CN1CCCCCC2=CC=CC=C21 |
| InChIKey | HFPUEPLWTACRID-UHFFFAOYSA-N |
Product Overview
1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- (CAS 33494-18-7), with molecular formula C12H17N and molecular weight 175.14 g/mol. IUPAC: 1-methyl-3,4,5,6-tetrahydro-2H-1-benzazocine.
Chemical Property Profile of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-
Property Insights of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-
The XLogP value of 3.3 indicates that 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- has 0 hydrogen bond donor(s) and 1 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 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-?
The CAS number of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- is 33494-18-7.
What is the molecular formula of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-?
The molecular formula of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- is C12H17N.
What is the molecular weight of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-?
The molecular weight of 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- is 175.14 g/mol.
Where can I buy 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-?
You can request a quote for 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzazocine, 1,2,3,4,5,6-hexahydro-1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.