Pentanimidic acid, 5-bromo-, methyl ester
TL;DR: Pentanimidic acid, 5-bromo-, methyl ester (CAS 62287-99-4) is a chemical compound with molecular formula C6H12BrNO and molecular weight 193.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-bromopentanimidate
Also Known As: methyl 5-bromopentanimidate, Methyl-5-bromovalerimidate, Pentanimidic acid, 5-bromo-, methyl ester, 5-bromo-1-methoxy-pentan-1-imine, RefChem:368157
| Molecular Formula | C6H12BrNO |
|---|---|
| Molecular Weight | 193.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 193.01022 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 62287-99-4 |
|---|---|
| SMILES | COC(=N)CCCCBr |
| InChIKey | OCNSRLBSACJBRE-UHFFFAOYSA-N |
Product Overview
Pentanimidic acid, 5-bromo-, methyl ester (CAS 62287-99-4), with molecular formula C6H12BrNO and molecular weight 193.01 g/mol. IUPAC: methyl 5-bromopentanimidate.
Chemical Property Profile of Pentanimidic acid, 5-bromo-, methyl ester
Property Insights of Pentanimidic acid, 5-bromo-, methyl ester
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentanimidic acid, 5-bromo-, methyl ester. With a topological polar surface area (TPSA) of 33.1 Ų, Pentanimidic acid, 5-bromo-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanimidic acid, 5-bromo-, methyl ester 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 Pentanimidic acid, 5-bromo-, methyl ester?
The CAS number of Pentanimidic acid, 5-bromo-, methyl ester is 62287-99-4.
What is the molecular formula of Pentanimidic acid, 5-bromo-, methyl ester?
The molecular formula of Pentanimidic acid, 5-bromo-, methyl ester is C6H12BrNO.
What is the molecular weight of Pentanimidic acid, 5-bromo-, methyl ester?
The molecular weight of Pentanimidic acid, 5-bromo-, methyl ester is 193.01 g/mol.
Where can I buy Pentanimidic acid, 5-bromo-, methyl ester?
You can request a quote for Pentanimidic acid, 5-bromo-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanimidic acid, 5-bromo-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Pentanimidic acid, 5-bromo-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.