8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺
TL;DR: 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 (CAS 37483-70-8) is a chemical compound with molecular formula C10H12ClNO and molecular weight 197.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺
8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
Also Known As: 8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine, 9-chloro-6-oxabicyclo[5.4.0]undeca-8,10,12-trien-2-amine
| Molecular Formula | C10H12ClNO |
|---|---|
| Molecular Weight | 197.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.06075 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 37483-70-8 |
|---|---|
| SMILES | C1CC(C2=C(C=C(C=C2)Cl)OC1)N |
| InChIKey | AJOUGIAPSIVVMD-UHFFFAOYSA-N |
Product Overview
8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 (CAS 37483-70-8), with molecular formula C10H12ClNO and molecular weight 197.06 g/mol. IUPAC: 8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-amine.
Chemical Property Profile of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺
Property Insights of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺. With a topological polar surface area (TPSA) of 35.3 Ų, 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 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 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺?
The CAS number of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 is 37483-70-8.
What is the molecular formula of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺?
The molecular formula of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 is C10H12ClNO.
What is the molecular weight of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺?
The molecular weight of 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 is 197.06 g/mol.
Where can I buy 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺?
You can request a quote for 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺?
Yes, KEHONG BIO provides custom synthesis services for 8-氯-2,3,4,5-四氢-1-苯并氧杂环庚-5-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.