3-Isopropylamino-1,2-propanediol
TL;DR: 3-Isopropylamino-1,2-propanediol (CAS 6452-57-9) is a chemical compound with molecular formula C6H15NO2 and molecular weight 133.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(propan-2-ylamino)propane-1,2-diol
Also Known As: 3-isopropylamino-1,2-propanediol, 3-(Isopropylamino)propane-1,2-diol, 3-(Isopropylamino)-1,2-propanediol, Metoprolol EP Impurity N, 1,2-dihydroxy-3-isopropylaminopropane
| Molecular Formula | C6H15NO2 |
|---|---|
| Molecular Weight | 133.11 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 52.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 133.11028 |
| Heavy Atoms | 9 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 6452-57-9 |
|---|---|
| SMILES | CC(C)NCC(CO)O |
| InChIKey | YKBZGEJJKPNRSI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Isopropylamino-1,2-propanediol (CAS 6452-57-9), with molecular formula C6H15NO2 and molecular weight 133.11 g/mol. IUPAC: 3-(propan-2-ylamino)propane-1,2-diol.
Chemical Property Profile of 3-Isopropylamino-1,2-propanediol
Property Insights of 3-Isopropylamino-1,2-propanediol
The XLogP value of -0.7 indicates that 3-Isopropylamino-1,2-propanediol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 52.5 Ų, 3-Isopropylamino-1,2-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isopropylamino-1,2-propanediol has 3 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 3-Isopropylamino-1,2-propanediol?
The CAS number of 3-Isopropylamino-1,2-propanediol is 6452-57-9.
What is the molecular formula of 3-Isopropylamino-1,2-propanediol?
The molecular formula of 3-Isopropylamino-1,2-propanediol is C6H15NO2.
What is the molecular weight of 3-Isopropylamino-1,2-propanediol?
The molecular weight of 3-Isopropylamino-1,2-propanediol is 133.11 g/mol.
Where can I buy 3-Isopropylamino-1,2-propanediol?
You can request a quote for 3-Isopropylamino-1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isopropylamino-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-Isopropylamino-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.