1,2-Butadiene, 1,1,3,4,4,4-hexachloro-
TL;DR: 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- (CAS 56827-79-3) is a chemical compound with molecular formula C4Cl6 and molecular weight 257.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3,4,4,4-hexachlorobuta-1,2-diene
Also Known As: Cholenzyme, hexachloro-1,2-butadiene, hexachlorobuta-1,2-diene, 1,2-HEXACHLOROBUTADIENE, C4-Cl6
| Molecular Formula | C4Cl6 |
|---|---|
| Molecular Weight | 257.81 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 259.81018 |
| Heavy Atoms | 10 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 56827-79-3 |
|---|---|
| SMILES | C(=C(C(Cl)(Cl)Cl)Cl)=C(Cl)Cl |
| InChIKey | STDNZGWUBHRWPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Butadiene, 1,1,3,4,4,4-hexachloro- (CAS 56827-79-3), with molecular formula C4Cl6 and molecular weight 257.81 g/mol. IUPAC: 1,1,3,4,4,4-hexachlorobuta-1,2-diene.
Chemical Property Profile of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-
Property Insights of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-
The XLogP value of 3.8 indicates that 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- 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-Butadiene, 1,1,3,4,4,4-hexachloro-?
The CAS number of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- is 56827-79-3.
What is the molecular formula of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-?
The molecular formula of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- is C4Cl6.
What is the molecular weight of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-?
The molecular weight of 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- is 257.81 g/mol.
Where can I buy 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-?
You can request a quote for 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Butadiene, 1,1,3,4,4,4-hexachloro-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Butadiene, 1,1,3,4,4,4-hexachloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.