1,3-Butadiene, 1,1,2,3-tetrachloro-
TL;DR: 1,3-Butadiene, 1,1,2,3-tetrachloro- (CAS 921-09-5) is a chemical compound with molecular formula C4H2Cl4 and molecular weight 189.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,2,3-tetrachlorobuta-1,3-diene
Also Known As: Tetrachlorobutadiene, 1,1,2,3-TETRACHLOROBUTA-1,3-DIENE, Tetrachloro-1,3-butadiene, 1,3-Butadiene, tetrachloro-, 1,1,2,3-Tetrachloro-1,3-butadiene
| Molecular Formula | C4H2Cl4 |
|---|---|
| Molecular Weight | 189.89 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.8881 |
| Heavy Atoms | 8 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 921-09-5 |
|---|---|
| SMILES | C=C(C(=C(Cl)Cl)Cl)Cl |
| InChIKey | RCBKHVTUYAGMLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Butadiene, 1,1,2,3-tetrachloro- (CAS 921-09-5), with molecular formula C4H2Cl4 and molecular weight 189.89 g/mol. IUPAC: 1,1,2,3-tetrachlorobuta-1,3-diene.
Chemical Property Profile of 1,3-Butadiene, 1,1,2,3-tetrachloro-
Property Insights of 1,3-Butadiene, 1,1,2,3-tetrachloro-
The XLogP value of 3.8 indicates that 1,3-Butadiene, 1,1,2,3-tetrachloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Butadiene, 1,1,2,3-tetrachloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Butadiene, 1,1,2,3-tetrachloro- 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 1,3-Butadiene, 1,1,2,3-tetrachloro-?
The CAS number of 1,3-Butadiene, 1,1,2,3-tetrachloro- is 921-09-5.
What is the molecular formula of 1,3-Butadiene, 1,1,2,3-tetrachloro-?
The molecular formula of 1,3-Butadiene, 1,1,2,3-tetrachloro- is C4H2Cl4.
What is the molecular weight of 1,3-Butadiene, 1,1,2,3-tetrachloro-?
The molecular weight of 1,3-Butadiene, 1,1,2,3-tetrachloro- is 189.89 g/mol.
Where can I buy 1,3-Butadiene, 1,1,2,3-tetrachloro-?
You can request a quote for 1,3-Butadiene, 1,1,2,3-tetrachloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Butadiene, 1,1,2,3-tetrachloro-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butadiene, 1,1,2,3-tetrachloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.