1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol
TL;DR: 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol (CAS 147993-11-1) is a chemical compound with molecular formula C16H31NO2 and molecular weight 269.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(propan-2-ylamino)-3-[(4,7,7-trimethyl-3-bicyclo[4.1.0]heptanyl)oxy]propan-2-ol
Also Known As: 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol, 2-Propanol, 1-((1-methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-, 1-(propan-2-ylamino)-3-[(3,7,7-trimethyl-4-bicyclo[4.1.0]heptanyl)oxy]propan-2-ol, 1-[(Propan-2-yl)amino]-3-[(4,7,7-trimethylbicyclo[4.1.0]heptan-3-yl)oxy]propan-2-ol, RefChem:265596
| Molecular Formula | C16H31NO2 |
|---|---|
| Molecular Weight | 269.24 g/mol |
| LogP | 2.4326 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.23547 |
| Heavy Atoms | 19 |
| Complexity | 303.12405 |
Chemical Identifiers
| CAS Number | 147993-11-1 |
|---|---|
| SMILES | CC1CC2C(C2(C)C)CC1OCC(CNC(C)C)O |
Product Overview
1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol (CAS 147993-11-1), with molecular formula C16H31NO2 and molecular weight 269.24 g/mol. IUPAC: 1-(propan-2-ylamino)-3-[(4,7,7-trimethyl-3-bicyclo[4.1.0]heptanyl)oxy]propan-2-ol.
Chemical Property Profile of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol
Property Insights of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol
The XLogP value of 2.4326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol. With a topological polar surface area (TPSA) of 41.49 Ų, 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol 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 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol?
The CAS number of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol is 147993-11-1.
What is the molecular formula of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol?
The molecular formula of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol is C16H31NO2.
What is the molecular weight of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol?
The molecular weight of 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol is 269.24 g/mol.
Where can I buy 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol?
You can request a quote for 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-((1-Methylethyl)amino)-3-((4,7,7-trimethylbicyclo(4.1.0)hept-3-yl)oxy)-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.