1,2-Pentadiene, 1-bromo-4,4-dimethyl-
TL;DR: 1,2-Pentadiene, 1-bromo-4,4-dimethyl- (CAS 100207-07-6) is a chemical compound with molecular formula C7H11Br and molecular weight 174.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4,4-dimethylpenta-1,2-diene
Also Known As: 1,2-Pentadiene, 1-bromo-4,4-dimethyl-, 1-bromo-4,4-dimethylpenta-1,2-diene, 1,2-Pentadiene,1-bromo-4,4-dimethyl, 1-Bromo-4,4-dimethyl-1,2-pentadiene, (R)-1-Bromo-4,4-dimethyl-1,2-pentadiene
| Molecular Formula | C7H11Br |
|---|---|
| Molecular Weight | 174.00 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.00441 |
| Heavy Atoms | 8 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 100207-07-6 |
|---|---|
| SMILES | CC(C)(C)C=C=CBr |
| InChIKey | VUDKVCJBHLHDOV-UHFFFAOYSA-N |
Product Overview
1,2-Pentadiene, 1-bromo-4,4-dimethyl- (CAS 100207-07-6), with molecular formula C7H11Br and molecular weight 174.00 g/mol. IUPAC: 1-bromo-4,4-dimethylpenta-1,2-diene.
Chemical Property Profile of 1,2-Pentadiene, 1-bromo-4,4-dimethyl-
Property Insights of 1,2-Pentadiene, 1-bromo-4,4-dimethyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Pentadiene, 1-bromo-4,4-dimethyl-. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Pentadiene, 1-bromo-4,4-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Pentadiene, 1-bromo-4,4-dimethyl- 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 1,2-Pentadiene, 1-bromo-4,4-dimethyl-?
The CAS number of 1,2-Pentadiene, 1-bromo-4,4-dimethyl- is 100207-07-6.
What is the molecular formula of 1,2-Pentadiene, 1-bromo-4,4-dimethyl-?
The molecular formula of 1,2-Pentadiene, 1-bromo-4,4-dimethyl- is C7H11Br.
What is the molecular weight of 1,2-Pentadiene, 1-bromo-4,4-dimethyl-?
The molecular weight of 1,2-Pentadiene, 1-bromo-4,4-dimethyl- is 174.00 g/mol.
Where can I buy 1,2-Pentadiene, 1-bromo-4,4-dimethyl-?
You can request a quote for 1,2-Pentadiene, 1-bromo-4,4-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Pentadiene, 1-bromo-4,4-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Pentadiene, 1-bromo-4,4-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.