methyl N-(2-bromoprop-2-enyl)carbamate
TL;DR: methyl N-(2-bromoprop-2-enyl)carbamate (CAS 86766-66-7) is a chemical compound with molecular formula C5H8BrNO2 and molecular weight 192.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(2-bromoprop-2-enyl)carbamate
Also Known As: methyl N-(2-bromoprop-2-enyl)carbamate, methyl (2-bromoprop-2-en-1-yl)carbamate, 1,4,7,10,13-Pentaoxacyclohexadecane,15,15-dimethyl
| Molecular Formula | C5H8BrNO2 |
|---|---|
| Molecular Weight | 192.97 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.97385 |
| Heavy Atoms | 9 |
| Complexity | 124.0 |
Chemical Identifiers
| CAS Number | 86766-66-7 |
|---|---|
| SMILES | COC(=O)NCC(=C)Br |
| InChIKey | RBYHCAGZQVOTPK-UHFFFAOYSA-N |
Product Overview
methyl N-(2-bromoprop-2-enyl)carbamate (CAS 86766-66-7), with molecular formula C5H8BrNO2 and molecular weight 192.97 g/mol. IUPAC: methyl N-(2-bromoprop-2-enyl)carbamate.
Chemical Property Profile of methyl N-(2-bromoprop-2-enyl)carbamate
Property Insights of methyl N-(2-bromoprop-2-enyl)carbamate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(2-bromoprop-2-enyl)carbamate. With a topological polar surface area (TPSA) of 38.3 Ų, methyl N-(2-bromoprop-2-enyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-(2-bromoprop-2-enyl)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
Frequently Asked Questions
What is the CAS number of methyl N-(2-bromoprop-2-enyl)carbamate?
The CAS number of methyl N-(2-bromoprop-2-enyl)carbamate is 86766-66-7.
What is the molecular formula of methyl N-(2-bromoprop-2-enyl)carbamate?
The molecular formula of methyl N-(2-bromoprop-2-enyl)carbamate is C5H8BrNO2.
What is the molecular weight of methyl N-(2-bromoprop-2-enyl)carbamate?
The molecular weight of methyl N-(2-bromoprop-2-enyl)carbamate is 192.97 g/mol.
Where can I buy methyl N-(2-bromoprop-2-enyl)carbamate?
You can request a quote for methyl N-(2-bromoprop-2-enyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-(2-bromoprop-2-enyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(2-bromoprop-2-enyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.