Heptane, 1-chloro-3-methyl-
TL;DR: Heptane, 1-chloro-3-methyl- (CAS 2350-21-2) is a chemical compound with molecular formula C8H17Cl and molecular weight 148.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-methylheptane
Also Known As: Heptane, 1-chloro-3-methyl-, 1-chloro-3-methylheptane, 1-Chlor-3-methyl-heptan, 1-chloro-3-methyl-heptane, RefChem:783654
| Molecular Formula | C8H17Cl |
|---|---|
| Molecular Weight | 148.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 148.10188 |
| Heavy Atoms | 9 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 2350-21-2 |
|---|---|
| SMILES | CCCCC(C)CCCl |
| InChIKey | AGDXAUBGPYHIEH-UHFFFAOYSA-N |
Product Overview
Heptane, 1-chloro-3-methyl- (CAS 2350-21-2), with molecular formula C8H17Cl and molecular weight 148.10 g/mol. IUPAC: 1-chloro-3-methylheptane.
Chemical Property Profile of Heptane, 1-chloro-3-methyl-
Property Insights of Heptane, 1-chloro-3-methyl-
The XLogP value of 4.1 indicates that Heptane, 1-chloro-3-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Heptane, 1-chloro-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptane, 1-chloro-3-methyl- 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 Heptane, 1-chloro-3-methyl-?
The CAS number of Heptane, 1-chloro-3-methyl- is 2350-21-2.
What is the molecular formula of Heptane, 1-chloro-3-methyl-?
The molecular formula of Heptane, 1-chloro-3-methyl- is C8H17Cl.
What is the molecular weight of Heptane, 1-chloro-3-methyl-?
The molecular weight of Heptane, 1-chloro-3-methyl- is 148.10 g/mol.
Where can I buy Heptane, 1-chloro-3-methyl-?
You can request a quote for Heptane, 1-chloro-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptane, 1-chloro-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Heptane, 1-chloro-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.