RefChem:1096669
TL;DR: RefChem:1096669 (CAS 105310-31-4) is a chemical compound with molecular formula C15H22ClNO2 and molecular weight 283.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R)-2-(4-methylphenyl)-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride
Also Known As: Cyclopropanecarboxylic acid, 2-(aminomethyl)-1-(4-methylphenyl)-, 1-methylethyl ester, (Z)-, monohydrochloride, (Z)-2-(Aminomethyl)-1-(4-methylphenyl)cyclopropanecarboxylic acid 1-methylethyl ester HCl, [(1S,2R)-2-(4-Methylphenyl)-2-propan-2-yloxycarbonylcyclopropyl]methylazaniumchloride, [(1S,2R)-2-(4-methylphenyl)-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride, CYCLOPROPANECARBOXYLIC ACID, 2-(AMINOMETHYL)-1-(4-METHYLPHENYL)-, 1-METHYLETHYL
| Molecular Formula | C15H22ClNO2 |
|---|---|
| Molecular Weight | 283.13 g/mol |
| LogP | -1.55 |
| Topological Polar Surface Area | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.1339 |
| Heavy Atoms | 19 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 105310-31-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)[C@]2(C[C@@H]2C[NH3+])C(=O)OC(C)C.[Cl-] |
| InChIKey | ZPVDPSQRZGDIRI-PBCQUBLHSA-N |
Product Overview
RefChem:1096669 (CAS 105310-31-4), with molecular formula C15H22ClNO2 and molecular weight 283.13 g/mol. IUPAC: [(1S,2R)-2-(4-methylphenyl)-2-propan-2-yloxycarbonylcyclopropyl]methylazanium chloride.
Chemical Property Profile of RefChem:1096669
Property Insights of RefChem:1096669
The XLogP value of -1.55 indicates that RefChem:1096669 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:1096669 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1096669 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
Frequently Asked Questions
What is the CAS number of RefChem:1096669?
The CAS number of RefChem:1096669 is 105310-31-4.
What is the molecular formula of RefChem:1096669?
The molecular formula of RefChem:1096669 is C15H22ClNO2.
What is the molecular weight of RefChem:1096669?
The molecular weight of RefChem:1096669 is 283.13 g/mol.
Where can I buy RefChem:1096669?
You can request a quote for RefChem:1096669 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1096669?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1096669 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.