1-Bromo-3-methylpentane
TL;DR: 1-Bromo-3-methylpentane (CAS 51116-73-5) is a chemical compound with molecular formula C6H13Br and molecular weight 164.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-methylpentane
Also Known As: 1-BROMO-3-METHYLPENTANE, 3-Methylpentylbromide, Fmoc-Cit-OH, Pentane, 1-bromo-3-methyl-, 3-ethyl-1-butyl bromide
| Molecular Formula | C6H13Br |
|---|---|
| Molecular Weight | 164.02 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.02007 |
| Heavy Atoms | 7 |
| Complexity | 35.0 |
Chemical Identifiers
| CAS Number | 51116-73-5 |
|---|---|
| SMILES | CCC(C)CCBr |
| InChIKey | MDCCBJLCTOTLKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-3-methylpentane (CAS 51116-73-5), with molecular formula C6H13Br and molecular weight 164.02 g/mol. IUPAC: 1-bromo-3-methylpentane.
Chemical Property Profile of 1-Bromo-3-methylpentane
Property Insights of 1-Bromo-3-methylpentane
The XLogP value of 3.2 indicates that 1-Bromo-3-methylpentane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Bromo-3-methylpentane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3-methylpentane has 0 hydrogen bond donor(s) and 0 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 1-Bromo-3-methylpentane?
The CAS number of 1-Bromo-3-methylpentane is 51116-73-5.
What is the molecular formula of 1-Bromo-3-methylpentane?
The molecular formula of 1-Bromo-3-methylpentane is C6H13Br.
What is the molecular weight of 1-Bromo-3-methylpentane?
The molecular weight of 1-Bromo-3-methylpentane is 164.02 g/mol.
Where can I buy 1-Bromo-3-methylpentane?
You can request a quote for 1-Bromo-3-methylpentane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-3-methylpentane?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3-methylpentane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.