Benzene, 1,2,5-trimethyl-3-propyl
TL;DR: Benzene, 1,2,5-trimethyl-3-propyl (CAS 37985-31-2) is a chemical compound with molecular formula C12H18 and molecular weight 162.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,5-trimethyl-3-propylbenzene
Also Known As: Hexamethyl benzene, 1,2,5-trimethyl-3-propylbenzene, Benzene, 1,2,5-trimethyl-3-propyl
| Molecular Formula | C12H18 |
|---|---|
| Molecular Weight | 162.14 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.14085 |
| Heavy Atoms | 12 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 37985-31-2 |
|---|---|
| SMILES | CCCC1=CC(=CC(=C1C)C)C |
| InChIKey | FXNRGRCXYVLCQN-UHFFFAOYSA-N |
Product Overview
Benzene, 1,2,5-trimethyl-3-propyl (CAS 37985-31-2), with molecular formula C12H18 and molecular weight 162.14 g/mol. IUPAC: 1,2,5-trimethyl-3-propylbenzene.
Chemical Property Profile of Benzene, 1,2,5-trimethyl-3-propyl
Property Insights of Benzene, 1,2,5-trimethyl-3-propyl
The XLogP value of 4.4 indicates that Benzene, 1,2,5-trimethyl-3-propyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1,2,5-trimethyl-3-propyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,2,5-trimethyl-3-propyl 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 Benzene, 1,2,5-trimethyl-3-propyl?
The CAS number of Benzene, 1,2,5-trimethyl-3-propyl is 37985-31-2.
What is the molecular formula of Benzene, 1,2,5-trimethyl-3-propyl?
The molecular formula of Benzene, 1,2,5-trimethyl-3-propyl is C12H18.
What is the molecular weight of Benzene, 1,2,5-trimethyl-3-propyl?
The molecular weight of Benzene, 1,2,5-trimethyl-3-propyl is 162.14 g/mol.
Where can I buy Benzene, 1,2,5-trimethyl-3-propyl?
You can request a quote for Benzene, 1,2,5-trimethyl-3-propyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,2,5-trimethyl-3-propyl?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,2,5-trimethyl-3-propyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.