N-(4-氨基丁基)氨基甲酸叔丁酯
TL;DR: N-(4-氨基丁基)氨基甲酸叔丁酯 (CAS 68076-36-8) is a chemical compound with molecular formula C9H20N2O2 and molecular weight 188.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-氨基丁基)氨基甲酸叔丁酯
tert-butyl N-(4-aminobutyl)carbamate
Also Known As: tert-Butyl N-(4-aminobutyl)carbamate, N-Boc-1,4-butanediamine, N-Boc-1,4-diaminobutane, tert-Butyl (4-aminobutyl)carbamate, NH2-C4-NH-Boc
| Molecular Formula | C9H20N2O2 |
|---|---|
| Molecular Weight | 188.15 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 188.15248 |
| Heavy Atoms | 13 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 68076-36-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCCCN |
| InChIKey | ZFQWJXFJJZUVPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-氨基丁基)氨基甲酸叔丁酯 (CAS 68076-36-8), with molecular formula C9H20N2O2 and molecular weight 188.15 g/mol. IUPAC: tert-butyl N-(4-aminobutyl)carbamate.
Chemical Property Profile of N-(4-氨基丁基)氨基甲酸叔丁酯
Property Insights of N-(4-氨基丁基)氨基甲酸叔丁酯
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-氨基丁基)氨基甲酸叔丁酯. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-氨基丁基)氨基甲酸叔丁酯. Following Lipinski's Rule of Five, tert-butyl N-(4-aminobutyl)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 N-(4-aminobutyl)carbamate?
The CAS number of tert-butyl N-(4-aminobutyl)carbamate is 68076-36-8.
What is the molecular formula of tert-butyl N-(4-aminobutyl)carbamate?
The molecular formula of tert-butyl N-(4-aminobutyl)carbamate is C9H20N2O2.
What is the molecular weight of tert-butyl N-(4-aminobutyl)carbamate?
The molecular weight of tert-butyl N-(4-aminobutyl)carbamate is 188.15 g/mol.
Where can I buy tert-butyl N-(4-aminobutyl)carbamate?
You can request a quote for tert-butyl N-(4-aminobutyl)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 N-(4-aminobutyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-(4-aminobutyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.