![3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol structure](/static/products/869/869943-99-7.png)
3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol
TL;DR: 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol (CAS 869943-99-7) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylmethylamino)propan-1-ol
Also Known As: 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol, ASN 07020363, 3-(1,3-benzodioxol-5-ylmethylamino)propan-1-ol, 3-[(1,3-benzodioxol-5-ylmethyl)amino]-1-propanol, 3-[(2H-1,3-benzodioxol-5-ylmethyl)amino]propan-1-ol
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 0.8873 |
| Topological Polar Surface Area | 50.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 327.6091 |
Chemical Identifiers
| CAS Number | 869943-99-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNCCCO |
Product Overview
3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol (CAS 869943-99-7), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethylamino)propan-1-ol.
Chemical Property Profile of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol
Property Insights of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol
The XLogP value of 0.8873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol. With a topological polar surface area (TPSA) of 50.72 Ų, 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol has 2 hydrogen bond donor(s) and 4 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-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol?
The CAS number of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol is 869943-99-7.
What is the molecular formula of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol?
The molecular formula of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol is C11H15NO3.
What is the molecular weight of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol?
The molecular weight of 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol is 209.11 g/mol.
Where can I buy 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol?
You can request a quote for 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.