Benzene, 1-methyl-3-propyl-
TL;DR: Benzene, 1-methyl-3-propyl- (CAS 1074-43-7) is a chemical compound with molecular formula C10H14 and molecular weight 134.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-propylbenzene
Also Known As: 3-Propyltoluene, 1-METHYL-3-PROPYLBENZENE, m-Propyltoluene, 3-n-Propyltoluene, Toluene, m-propyl-
| Molecular Formula | C10H14 |
|---|---|
| Molecular Weight | 134.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.10954 |
| Heavy Atoms | 10 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 1074-43-7 |
|---|---|
| SMILES | CCCC1=CC=CC(=C1)C |
| InChIKey | QUEBYVKXYIKVSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-methyl-3-propyl- (CAS 1074-43-7), with molecular formula C10H14 and molecular weight 134.11 g/mol. IUPAC: 1-methyl-3-propylbenzene.
Chemical Property Profile of Benzene, 1-methyl-3-propyl-
Property Insights of Benzene, 1-methyl-3-propyl-
The XLogP value of 3.6 indicates that Benzene, 1-methyl-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-methyl-3-propyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-methyl-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-methyl-3-propyl-?
The CAS number of Benzene, 1-methyl-3-propyl- is 1074-43-7.
What is the molecular formula of Benzene, 1-methyl-3-propyl-?
The molecular formula of Benzene, 1-methyl-3-propyl- is C10H14.
What is the molecular weight of Benzene, 1-methyl-3-propyl-?
The molecular weight of Benzene, 1-methyl-3-propyl- is 134.11 g/mol.
Where can I buy Benzene, 1-methyl-3-propyl-?
You can request a quote for Benzene, 1-methyl-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-methyl-3-propyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methyl-3-propyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.