3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid
TL;DR: 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid (CAS 34644-12-7) is a chemical compound with molecular formula C5HCl5O2 and molecular weight 267.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic acid
Also Known As: AmbscPOD_02/0643, 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid, 2-dichloromethylene-3,4,4-trichloro-3-butenoic acid, 3-Butenoic acid, 3,4,4-trichloro-2-(dichloromethylene)-
| Molecular Formula | C5HCl5O2 |
|---|---|
| Molecular Weight | 267.84 g/mol |
| LogP | 3.6457 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.84192 |
| Heavy Atoms | 12 |
| Complexity | 259.01215 |
Chemical Identifiers
| CAS Number | 34644-12-7 |
|---|---|
| SMILES | C(=C(Cl)Cl)(C(=C(Cl)Cl)Cl)C(=O)O |
Product Overview
3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid (CAS 34644-12-7), with molecular formula C5HCl5O2 and molecular weight 267.84 g/mol. IUPAC: 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic acid.
Chemical Property Profile of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid
Property Insights of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid
The XLogP value of 3.6457 indicates that 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid has 1 hydrogen bond donor(s) and 1 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 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid?
The CAS number of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid is 34644-12-7.
What is the molecular formula of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid?
The molecular formula of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid is C5HCl5O2.
What is the molecular weight of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid?
The molecular weight of 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid is 267.84 g/mol.
Where can I buy 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid?
You can request a quote for 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4,4-trichloro-2-(dichloromethylidene)but-3-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.