Pentane, 1,5-dichloro-3-methyl-
TL;DR: Pentane, 1,5-dichloro-3-methyl- (CAS 56702-89-7) is a chemical compound with molecular formula C6H12Cl2 and molecular weight 154.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dichloro-3-methylpentane
Also Known As: 1,5-dichloro-3-methylpentane, Pentane, 1,5-dichloro-3-methyl-, 3-METHYL-1,5-DICHLOROPENTANE, Pentane, 1,5-dichloro-3-methyl-,, J3.751.414D
| Molecular Formula | C6H12Cl2 |
|---|---|
| Molecular Weight | 154.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.0316 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 56702-89-7 |
|---|---|
| SMILES | CC(CCCl)CCCl |
| InChIKey | ITPYJYKCTJIIJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentane, 1,5-dichloro-3-methyl- (CAS 56702-89-7), with molecular formula C6H12Cl2 and molecular weight 154.03 g/mol. IUPAC: 1,5-dichloro-3-methylpentane.
Chemical Property Profile of Pentane, 1,5-dichloro-3-methyl-
Property Insights of Pentane, 1,5-dichloro-3-methyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentane, 1,5-dichloro-3-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, Pentane, 1,5-dichloro-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentane, 1,5-dichloro-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 Pentane, 1,5-dichloro-3-methyl-?
The CAS number of Pentane, 1,5-dichloro-3-methyl- is 56702-89-7.
What is the molecular formula of Pentane, 1,5-dichloro-3-methyl-?
The molecular formula of Pentane, 1,5-dichloro-3-methyl- is C6H12Cl2.
What is the molecular weight of Pentane, 1,5-dichloro-3-methyl-?
The molecular weight of Pentane, 1,5-dichloro-3-methyl- is 154.03 g/mol.
Where can I buy Pentane, 1,5-dichloro-3-methyl-?
You can request a quote for Pentane, 1,5-dichloro-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentane, 1,5-dichloro-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pentane, 1,5-dichloro-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.