2-Propanol, 1-anilino-3-(2-propynyloxy)-
TL;DR: 2-Propanol, 1-anilino-3-(2-propynyloxy)- (CAS 26671-45-4) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-3-prop-2-ynoxypropan-2-ol
Also Known As: 66100 MD, 1-Anilino-3-(2-propynyloxy)-2-propanol, 1-anilino-3-prop-2-ynoxypropan-2-ol, 2-Propanol, 1-anilino-3-(2-propynyloxy)-, KST-1B2458
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 26671-45-4 |
|---|---|
| SMILES | C#CCOCC(CNC1=CC=CC=C1)O |
| InChIKey | GMOSHJHOTUTWOV-UHFFFAOYSA-N |
Product Overview
2-Propanol, 1-anilino-3-(2-propynyloxy)- (CAS 26671-45-4), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 1-anilino-3-prop-2-ynoxypropan-2-ol.
Chemical Property Profile of 2-Propanol, 1-anilino-3-(2-propynyloxy)-
Property Insights of 2-Propanol, 1-anilino-3-(2-propynyloxy)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-anilino-3-(2-propynyloxy)-. With a topological polar surface area (TPSA) of 41.5 Ų, 2-Propanol, 1-anilino-3-(2-propynyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propanol, 1-anilino-3-(2-propynyloxy)- has 2 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 2-Propanol, 1-anilino-3-(2-propynyloxy)-?
The CAS number of 2-Propanol, 1-anilino-3-(2-propynyloxy)- is 26671-45-4.
What is the molecular formula of 2-Propanol, 1-anilino-3-(2-propynyloxy)-?
The molecular formula of 2-Propanol, 1-anilino-3-(2-propynyloxy)- is C12H15NO2.
What is the molecular weight of 2-Propanol, 1-anilino-3-(2-propynyloxy)-?
The molecular weight of 2-Propanol, 1-anilino-3-(2-propynyloxy)- is 205.11 g/mol.
Where can I buy 2-Propanol, 1-anilino-3-(2-propynyloxy)-?
You can request a quote for 2-Propanol, 1-anilino-3-(2-propynyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanol, 1-anilino-3-(2-propynyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanol, 1-anilino-3-(2-propynyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.