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Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine
TL;DR: Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine (CAS 447429-09-6) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amine
Also Known As: spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amine, ZERO/006049, Spiro(benzo[1,3]dioxole-2,1'-cyclopentan)-5-ylamine, spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine, Spiro[benzo[d][1,3]dioxole-2,1'-cyclopentan]-5-amine
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 447429-09-6 |
|---|---|
| SMILES | C1CCC2(C1)OC3=C(O2)C=C(C=C3)N |
| InChIKey | BZDIQBHWAGKIDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine (CAS 447429-09-6), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-amine.
Chemical Property Profile of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine
Property Insights of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine. With a topological polar surface area (TPSA) of 44.5 Ų, Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-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 Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine?
The CAS number of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine is 447429-09-6.
What is the molecular formula of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine?
The molecular formula of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine is C11H13NO2.
What is the molecular weight of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine?
The molecular weight of Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine is 191.09 g/mol.
Where can I buy Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine?
You can request a quote for Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine?
Yes, KEHONG BIO provides custom synthesis services for Spiro[1,3-benzodioxole-2,1'-cyclopentan]-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.