RefChem:1082776
TL;DR: RefChem:1082776 (CAS 105310-29-0) is a chemical compound with molecular formula C14H20ClNO2 and molecular weight 269.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,2R)-2-phenyl-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride
Also Known As: (Z)-Isopropyl 1-phenyl-2-(aminomethyl)cyclopropanecarboxylate hydrochloride, Cyclopropanecarboxylic acid, 2-(aminomethyl)-1-phenyl-, 1-methylethyl ester, (Z)-, monohydrochloride, [(1S,2R)-2-Phenyl-2-propan-2-yloxycarbonylcyclopropyl]methylazaniumchloride, [(1S,2R)-2-phenyl-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride, CYCLOPROPANECARBOXYLIC ACID, 2-(AMINOMETHYL)-1-PHENYL-, 1-METHYLETHYL ESTER, (Z)
Technical Specifications
| Molecular Formula | C14H20ClNO2 |
| Molecular Weight | 269.11826 g/mol |
| XLogP | -1.86 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 269.11826 Da |
| Heavy Atoms | 18 |
| Complexity | 284.0 |
| SMILES | CC(C)OC(=O)[C@@]1(C[C@@H]1C[NH3+])C2=CC=CC=C2.[Cl-] |
| InChIKey | PKKPTPQOBVSZFC-OJMBIDBESA-N |
Chemical Property Profile of RefChem:1082776
Property Insights of RefChem:1082776
The XLogP value of -1.86 indicates that RefChem:1082776 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.9 Ų, RefChem:1082776 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1082776 has 1 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 RefChem:1082776?
The CAS number of RefChem:1082776 is 105310-29-0.
What is the molecular formula of RefChem:1082776?
The molecular formula of RefChem:1082776 is C14H20ClNO2.
What is the molecular weight of RefChem:1082776?
The molecular weight of RefChem:1082776 is 269.11826 g/mol.
Where can I buy RefChem:1082776?
You can request a quote for RefChem:1082776 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1082776?
Yes, CoreyChem provides custom synthesis services for RefChem:1082776 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.