3,4-dihydro-2H-1,5-benzodioxepin-7-amine
TL;DR: 3,4-dihydro-2H-1,5-benzodioxepin-7-amine (CAS 175136-34-2) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-1,5-benzodioxepin-7-amine
Also Known As: 3,4-Dihydro-2H-1,5-benzodioxepin-7-amine, Maybridge1_002016, buttpark 12115-34, 3,4-trimethylenedioxyaniline, 2H-1,5-Benzodioxepin-7-amine, 3,4-dihydro-
| Molecular Formula | C9H11NO2 |
|---|---|
| Molecular Weight | 165.08 g/mol |
| LogP | 1.4301 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 165.07898 |
| Heavy Atoms | 12 |
| Complexity | 285.85706 |
Chemical Identifiers
| CAS Number | 175136-34-2 |
|---|---|
| SMILES | C1COC2=C(C=C(C=C2)N)OC1 |
Product Overview
3,4-dihydro-2H-1,5-benzodioxepin-7-amine (CAS 175136-34-2), with molecular formula C9H11NO2 and molecular weight 165.08 g/mol. IUPAC: 3,4-dihydro-2H-1,5-benzodioxepin-7-amine.
Chemical Property Profile of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine
Property Insights of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine
The XLogP value of 1.4301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-dihydro-2H-1,5-benzodioxepin-7-amine. With a topological polar surface area (TPSA) of 44.48 Ų, 3,4-dihydro-2H-1,5-benzodioxepin-7-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dihydro-2H-1,5-benzodioxepin-7-amine has 1 hydrogen bond donor(s) and 3 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 3,4-dihydro-2H-1,5-benzodioxepin-7-amine?
The CAS number of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine is 175136-34-2.
What is the molecular formula of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine?
The molecular formula of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine is C9H11NO2.
What is the molecular weight of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine?
The molecular weight of 3,4-dihydro-2H-1,5-benzodioxepin-7-amine is 165.08 g/mol.
Where can I buy 3,4-dihydro-2H-1,5-benzodioxepin-7-amine?
You can request a quote for 3,4-dihydro-2H-1,5-benzodioxepin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dihydro-2H-1,5-benzodioxepin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dihydro-2H-1,5-benzodioxepin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.