Mesitylene, 2-propadienyl-
TL;DR: Mesitylene, 2-propadienyl- (CAS 29555-07-5) is a chemical compound with molecular formula C12H14 and molecular weight 158.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethyl-2-propa-1,2-dienylbenzene
Also Known As: Allenylmesitylen, Mesitylene, 2-propadienyl-, 2-Propadienylmesitylene, 1,3,5-trimethyl-2-propa-1,2-dienylbenzene, Benzene, 1,3,5-trimethyl-2-(1,2-propadienyl)-
| Molecular Formula | C12H14 |
|---|---|
| Molecular Weight | 158.11 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.10954 |
| Heavy Atoms | 12 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 29555-07-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)C=C=C)C |
| InChIKey | DNYPZTRMJKEVIO-UHFFFAOYSA-N |
Product Overview
Mesitylene, 2-propadienyl- (CAS 29555-07-5), with molecular formula C12H14 and molecular weight 158.11 g/mol. IUPAC: 1,3,5-trimethyl-2-propa-1,2-dienylbenzene.
Chemical Property Profile of Mesitylene, 2-propadienyl-
Property Insights of Mesitylene, 2-propadienyl-
The XLogP value of 3.4 indicates that Mesitylene, 2-propadienyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Mesitylene, 2-propadienyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mesitylene, 2-propadienyl- 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 Mesitylene, 2-propadienyl-?
The CAS number of Mesitylene, 2-propadienyl- is 29555-07-5.
What is the molecular formula of Mesitylene, 2-propadienyl-?
The molecular formula of Mesitylene, 2-propadienyl- is C12H14.
What is the molecular weight of Mesitylene, 2-propadienyl-?
The molecular weight of Mesitylene, 2-propadienyl- is 158.11 g/mol.
Where can I buy Mesitylene, 2-propadienyl-?
You can request a quote for Mesitylene, 2-propadienyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesitylene, 2-propadienyl-?
Yes, KEHONG BIO provides custom synthesis services for Mesitylene, 2-propadienyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.