tert-Butyl N-(2-bromoethyl)carbamate
TL;DR: tert-Butyl N-(2-bromoethyl)carbamate (CAS 1250986-06-1) is a chemical compound with molecular formula C7H14BrNO2 and molecular weight 223.02078 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-(2-bromoethyl)carbamate
Also Known As: tert-Butyl N-(2-bromoethyl)carbamate, n-boc-bromoethylamine, 2-(Boc-amino)ethyl bromide, tert-Butyl (2-bromoethyl)carbamate, N-Boc-2-bromoethylamine
Technical Specifications
| Molecular Formula | C7H14BrNO2 |
| Molecular Weight | 223.02078 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.02078 Da |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
| SMILES | CC(C)(C)OC(=O)NCCBr |
| InChIKey | TZRQZPMQUXEZMC-UHFFFAOYSA-N |
Chemical Property Profile of tert-Butyl N-(2-bromoethyl)carbamate
Property Insights of tert-Butyl N-(2-bromoethyl)carbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl N-(2-bromoethyl)carbamate. With a topological polar surface area (TPSA) of 38.3 Ų, tert-Butyl N-(2-bromoethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl N-(2-bromoethyl)carbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of tert-Butyl N-(2-bromoethyl)carbamate?
The CAS number of tert-Butyl N-(2-bromoethyl)carbamate is 1250986-06-1.
What is the molecular formula of tert-Butyl N-(2-bromoethyl)carbamate?
The molecular formula of tert-Butyl N-(2-bromoethyl)carbamate is C7H14BrNO2.
What is the molecular weight of tert-Butyl N-(2-bromoethyl)carbamate?
The molecular weight of tert-Butyl N-(2-bromoethyl)carbamate is 223.02078 g/mol.
Where can I buy tert-Butyl N-(2-bromoethyl)carbamate?
You can request a quote for tert-Butyl N-(2-bromoethyl)carbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tert-Butyl N-(2-bromoethyl)carbamate?
Yes, CoreyChem provides custom synthesis services for tert-Butyl N-(2-bromoethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.