Benzene, (1E,3E)-1,3-hexadienyl-
TL;DR: Benzene, (1E,3E)-1,3-hexadienyl- (CAS 41635-77-2) 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.
hexa-1,3-dienylbenzene
Also Known As: phenylhexadiene, Hexa-1,3-dienylbenzene, Benzene, (1E,3E)-1,3-hexadienyl-, (hexa-1,3-dien-1-yl)benzene, Benzene,(1E,3E)-1,3-hexadienyl
| Molecular Formula | C12H14 |
|---|---|
| Molecular Weight | 158.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 158.10954 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 41635-77-2 |
|---|---|
| SMILES | CCC=CC=CC1=CC=CC=C1 |
| InChIKey | DHGJWSRGFMFRLS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, (1E,3E)-1,3-hexadienyl- (CAS 41635-77-2), with molecular formula C12H14 and molecular weight 158.11 g/mol. IUPAC: hexa-1,3-dienylbenzene.
Chemical Property Profile of Benzene, (1E,3E)-1,3-hexadienyl-
Property Insights of Benzene, (1E,3E)-1,3-hexadienyl-
The XLogP value of 4.0 indicates that Benzene, (1E,3E)-1,3-hexadienyl- 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, (1E,3E)-1,3-hexadienyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, (1E,3E)-1,3-hexadienyl- 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, (1E,3E)-1,3-hexadienyl-?
The CAS number of Benzene, (1E,3E)-1,3-hexadienyl- is 41635-77-2.
What is the molecular formula of Benzene, (1E,3E)-1,3-hexadienyl-?
The molecular formula of Benzene, (1E,3E)-1,3-hexadienyl- is C12H14.
What is the molecular weight of Benzene, (1E,3E)-1,3-hexadienyl-?
The molecular weight of Benzene, (1E,3E)-1,3-hexadienyl- is 158.11 g/mol.
Where can I buy Benzene, (1E,3E)-1,3-hexadienyl-?
You can request a quote for Benzene, (1E,3E)-1,3-hexadienyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, (1E,3E)-1,3-hexadienyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, (1E,3E)-1,3-hexadienyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.