trans-1,3,3-Trichloro-1-propene
TL;DR: trans-1,3,3-Trichloro-1-propene (CAS 2598-01-8) is a chemical compound with molecular formula C3H3Cl3 and molecular weight 143.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1,3,3-trichloroprop-1-ene
Also Known As: 3-trichloropropene, 1,3,3-Trichloropropene, 1-Propene, 1,3,3-trichloro-, 1,3,3-trichloroprop-1-ene, trans-1,3,3-Trichloro-1-propene
| Molecular Formula | C3H3Cl3 |
|---|---|
| Molecular Weight | 143.93 g/mol |
| LogP | 2.5426 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.93004 |
| Heavy Atoms | 6 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 2598-01-8 |
|---|---|
| SMILES | C(=C/Cl)\C(Cl)Cl |
Product Overview
trans-1,3,3-Trichloro-1-propene (CAS 2598-01-8), with molecular formula C3H3Cl3 and molecular weight 143.93 g/mol. IUPAC: (E)-1,3,3-trichloroprop-1-ene.
Chemical Property Profile of trans-1,3,3-Trichloro-1-propene
Property Insights of trans-1,3,3-Trichloro-1-propene
The XLogP value of 2.5426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-1,3,3-Trichloro-1-propene. With a topological polar surface area (TPSA) of 0.0 Ų, trans-1,3,3-Trichloro-1-propene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-1,3,3-Trichloro-1-propene 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 trans-1,3,3-Trichloro-1-propene?
The CAS number of trans-1,3,3-Trichloro-1-propene is 2598-01-8.
What is the molecular formula of trans-1,3,3-Trichloro-1-propene?
The molecular formula of trans-1,3,3-Trichloro-1-propene is C3H3Cl3.
What is the molecular weight of trans-1,3,3-Trichloro-1-propene?
The molecular weight of trans-1,3,3-Trichloro-1-propene is 143.93 g/mol.
Where can I buy trans-1,3,3-Trichloro-1-propene?
You can request a quote for trans-1,3,3-Trichloro-1-propene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-1,3,3-Trichloro-1-propene?
Yes, KEHONG BIO provides custom synthesis services for trans-1,3,3-Trichloro-1-propene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.