1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-
TL;DR: 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- (CAS 2549-31-7) is a chemical compound with molecular formula C13H18F3NO and molecular weight 261.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]propan-1-ol
Also Known As: 3-(alpha-Methyl-m-trifluoromethylphenethylamino)-1-propanol, 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-, 3-({1-[3-(trifluoromethyl)phenyl]propan-2-yl}amino)propan-1-ol, 3-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]propan-1-ol, 3-[[1-Methyl-2-[3-(trifluoromethyl)phenyl]ethyl]amino]-1-propanol
| Molecular Formula | C13H18F3NO |
|---|---|
| Molecular Weight | 261.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.13406 |
| Heavy Atoms | 18 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 2549-31-7 |
|---|---|
| SMILES | CC(CC1=CC(=CC=C1)C(F)(F)F)NCCCO |
| InChIKey | XFUOIIGOAIUWRS-UHFFFAOYSA-N |
Product Overview
1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- (CAS 2549-31-7), with molecular formula C13H18F3NO and molecular weight 261.13 g/mol. IUPAC: 3-[1-[3-(trifluoromethyl)phenyl]propan-2-ylamino]propan-1-ol.
Chemical Property Profile of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-
Property Insights of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- has 2 hydrogen bond donor(s) and 5 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-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-?
The CAS number of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- is 2549-31-7.
What is the molecular formula of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-?
The molecular formula of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- is C13H18F3NO.
What is the molecular weight of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-?
The molecular weight of 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- is 261.13 g/mol.
Where can I buy 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-?
You can request a quote for 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 3-(alpha-methyl-m-trifluoromethylphenethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.