2-Propanol, 1-amino-, benzoate (1:1)
TL;DR: 2-Propanol, 1-amino-, benzoate (1:1) (CAS 110902-33-5) is a chemical compound with molecular formula C10H15NO3 and molecular weight 197.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-aminopropan-2-ol;benzoic acid
Also Known As: 2-Propanol, 1-amino-, benzoate (salt), Benzoic acid, monoisopropanolamine salt, 1-aminopropan-2-ol benzoate(1:1), 1-aminopropan-2-ol,benzoic acid, 1-aminopropan-2-ol; benzoic acid
Technical Specifications
| Molecular Formula | C10H15NO3 |
| Molecular Weight | 197.1052 g/mol |
| XLogP | 0.7107 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.1052 Da |
| Heavy Atoms | 14 |
| Complexity | 126.0 |
| SMILES | CC(CN)O.C1=CC=C(C=C1)C(=O)O |
| InChIKey | LAMQQBZIVULKMS-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propanol, 1-amino-, benzoate (1:1)
Property Insights of 2-Propanol, 1-amino-, benzoate (1:1)
The XLogP value of 0.7107 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-amino-, benzoate (1:1). The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanol, 1-amino-, benzoate (1:1). Following Lipinski's Rule of Five, 2-Propanol, 1-amino-, benzoate (1:1) has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propanol, 1-amino-, benzoate (1:1)?
The CAS number of 2-Propanol, 1-amino-, benzoate (1:1) is 110902-33-5.
What is the molecular formula of 2-Propanol, 1-amino-, benzoate (1:1)?
The molecular formula of 2-Propanol, 1-amino-, benzoate (1:1) is C10H15NO3.
What is the molecular weight of 2-Propanol, 1-amino-, benzoate (1:1)?
The molecular weight of 2-Propanol, 1-amino-, benzoate (1:1) is 197.1052 g/mol.
Where can I buy 2-Propanol, 1-amino-, benzoate (1:1)?
You can request a quote for 2-Propanol, 1-amino-, benzoate (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propanol, 1-amino-, benzoate (1:1)?
Yes, CoreyChem provides custom synthesis services for 2-Propanol, 1-amino-, benzoate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.