Benzyl (3-aminopropyl)carbamate
TL;DR: Benzyl (3-aminopropyl)carbamate (CAS 46460-73-5) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(3-aminopropyl)carbamate
Also Known As: Benzyl (3-aminopropyl)carbamate, benzyl N-(3-aminopropyl)carbamate, n-cbz-1,3-diaminopropane, benzyl 3-aminopropylcarbamate, Benzyl(3-aminopropyl)carbamate
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 46460-73-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NCCCN |
| InChIKey | JXWABCYGGVHAHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl (3-aminopropyl)carbamate (CAS 46460-73-5), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: benzyl N-(3-aminopropyl)carbamate.
Chemical Property Profile of Benzyl (3-aminopropyl)carbamate
Property Insights of Benzyl (3-aminopropyl)carbamate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl (3-aminopropyl)carbamate. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl (3-aminopropyl)carbamate. Following Lipinski's Rule of Five, Benzyl (3-aminopropyl)carbamate has 2 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 Benzyl (3-aminopropyl)carbamate?
The CAS number of Benzyl (3-aminopropyl)carbamate is 46460-73-5.
What is the molecular formula of Benzyl (3-aminopropyl)carbamate?
The molecular formula of Benzyl (3-aminopropyl)carbamate is C11H16N2O2.
What is the molecular weight of Benzyl (3-aminopropyl)carbamate?
The molecular weight of Benzyl (3-aminopropyl)carbamate is 208.12 g/mol.
Where can I buy Benzyl (3-aminopropyl)carbamate?
You can request a quote for Benzyl (3-aminopropyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl (3-aminopropyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl (3-aminopropyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.