Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-
TL;DR: Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- (CAS 61693-02-5) is a chemical compound with molecular formula C16H13Br and molecular weight 284.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-[3-(4-methylphenyl)propa-1,2-dienyl]benzene
Also Known As: 1-p-Bromphenyl-3-p-methylphenylallen, 1-(4-Bromophenyl)-3-(4-methylphenyl)allene, Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-, 1-Bromo-4-[3-(4-methylphenyl)propadienyl]benzene, 1-(4-Bromophenyl)-3-(4-methylphenyl)-1,2-propanediene
| Molecular Formula | C16H13Br |
|---|---|
| Molecular Weight | 284.02 g/mol |
| LogP | 5.08302 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.02005 |
| Heavy Atoms | 17 |
| Complexity | 491.58398 |
Chemical Identifiers
| CAS Number | 61693-02-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C=C=CC2=CC=C(C=C2)Br |
Product Overview
Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- (CAS 61693-02-5), with molecular formula C16H13Br and molecular weight 284.02 g/mol. IUPAC: 1-bromo-4-[3-(4-methylphenyl)propa-1,2-dienyl]benzene.
Chemical Property Profile of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-
Property Insights of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-
The XLogP value of 5.08302 indicates that Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-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, Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-?
The CAS number of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- is 61693-02-5.
What is the molecular formula of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-?
The molecular formula of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- is C16H13Br.
What is the molecular weight of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-?
The molecular weight of Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- is 284.02 g/mol.
Where can I buy Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-?
You can request a quote for Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-bromo-4-[3-(4-methylphenyl)-1,2-propadienyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.