3',4',5'-Trimethoxycinnamoyl chloride
TL;DR: 3',4',5'-Trimethoxycinnamoyl chloride (CAS 89652-61-9) is a chemical compound with molecular formula C12H13ClO4 and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl chloride
Also Known As: 3',4',5'-Trimethoxycinnamoyl chloride, Cinepazide Impurity 7, Cinepazide Impurity 12, EINECS 233-601-3, 3-(3,4,5-trimethoxyphenyl)prop-2-enoyl chloride
| Molecular Formula | C12H13ClO4 |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 2.491 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.05023 |
| Heavy Atoms | 17 |
| Complexity | 415.12692 |
Chemical Identifiers
| CAS Number | 89652-61-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)Cl |
Product Overview
3',4',5'-Trimethoxycinnamoyl chloride (CAS 89652-61-9), with molecular formula C12H13ClO4 and molecular weight 256.05 g/mol. IUPAC: (E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl chloride.
Chemical Property Profile of 3',4',5'-Trimethoxycinnamoyl chloride
Property Insights of 3',4',5'-Trimethoxycinnamoyl chloride
The XLogP value of 2.491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3',4',5'-Trimethoxycinnamoyl chloride. With a topological polar surface area (TPSA) of 44.76 Ų, 3',4',5'-Trimethoxycinnamoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3',4',5'-Trimethoxycinnamoyl chloride has 0 hydrogen bond donor(s) and 4 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',5'-Trimethoxycinnamoyl chloride?
The CAS number of 3',4',5'-Trimethoxycinnamoyl chloride is 89652-61-9.
What is the molecular formula of 3',4',5'-Trimethoxycinnamoyl chloride?
The molecular formula of 3',4',5'-Trimethoxycinnamoyl chloride is C12H13ClO4.
What is the molecular weight of 3',4',5'-Trimethoxycinnamoyl chloride?
The molecular weight of 3',4',5'-Trimethoxycinnamoyl chloride is 256.05 g/mol.
Where can I buy 3',4',5'-Trimethoxycinnamoyl chloride?
You can request a quote for 3',4',5'-Trimethoxycinnamoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',4',5'-Trimethoxycinnamoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3',4',5'-Trimethoxycinnamoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.