Propan-2-yl propyl carbonate
TL;DR: Propan-2-yl propyl carbonate (CAS 119812-13-4) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl propyl carbonate
Also Known As: propan-2-yl propyl carbonate, Isopropyl propyl carbonate, Carbonic acid, isopropyl propyl ester, Carbonic acid, 1-methylethyl propyl ester, Kohlensaeure-isopropylester-propylester
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.0943 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.0943 Da |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
| SMILES | CCCOC(=O)OC(C)C |
| InChIKey | YSXQKGSCQVYVQV-UHFFFAOYSA-N |
Chemical Property Profile of Propan-2-yl propyl carbonate
Property Insights of Propan-2-yl propyl carbonate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propan-2-yl propyl carbonate. With a topological polar surface area (TPSA) of 35.5 Ų, Propan-2-yl propyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl propyl carbonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Propan-2-yl propyl carbonate?
The CAS number of Propan-2-yl propyl carbonate is 119812-13-4.
What is the molecular formula of Propan-2-yl propyl carbonate?
The molecular formula of Propan-2-yl propyl carbonate is C7H14O3.
What is the molecular weight of Propan-2-yl propyl carbonate?
The molecular weight of Propan-2-yl propyl carbonate is 146.0943 g/mol.
Where can I buy Propan-2-yl propyl carbonate?
You can request a quote for Propan-2-yl propyl carbonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Propan-2-yl propyl carbonate?
Yes, CoreyChem provides custom synthesis services for Propan-2-yl propyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.