tert-Butyl (3-aminopropyl)carbamate
TL;DR: tert-Butyl (3-aminopropyl)carbamate (CAS 75178-96-0) is a chemical compound with molecular formula C8H18N2O2 and molecular weight 174.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(3-aminopropyl)carbamate
Also Known As: N-Boc-1,3-propanediamine, N-Boc-1,3-diaminopropane, tert-Butyl (3-aminopropyl)carbamate, tert-Butyl N-(3-aminopropyl)carbamate, tert-butyl 3-aminopropylcarbamate
| Molecular Formula | C8H18N2O2 |
|---|---|
| Molecular Weight | 174.14 g/mol |
| LogP | 0.8599 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.13683 |
| Heavy Atoms | 12 |
| Complexity | 140.4835 |
Chemical Identifiers
| CAS Number | 75178-96-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCCN |
Product Overview
tert-Butyl (3-aminopropyl)carbamate (CAS 75178-96-0), with molecular formula C8H18N2O2 and molecular weight 174.14 g/mol. IUPAC: tert-butyl N-(3-aminopropyl)carbamate.
Chemical Property Profile of tert-Butyl (3-aminopropyl)carbamate
Property Insights of tert-Butyl (3-aminopropyl)carbamate
The XLogP value of 0.8599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl (3-aminopropyl)carbamate. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl (3-aminopropyl)carbamate. Following Lipinski's Rule of Five, tert-Butyl (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 tert-Butyl (3-aminopropyl)carbamate?
The CAS number of tert-Butyl (3-aminopropyl)carbamate is 75178-96-0.
What is the molecular formula of tert-Butyl (3-aminopropyl)carbamate?
The molecular formula of tert-Butyl (3-aminopropyl)carbamate is C8H18N2O2.
What is the molecular weight of tert-Butyl (3-aminopropyl)carbamate?
The molecular weight of tert-Butyl (3-aminopropyl)carbamate is 174.14 g/mol.
Where can I buy tert-Butyl (3-aminopropyl)carbamate?
You can request a quote for tert-Butyl (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 tert-Butyl (3-aminopropyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl (3-aminopropyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.