4-羟基-3,5-二异戊烯基肉桂酸
TL;DR: 4-羟基-3,5-二异戊烯基肉桂酸 (CAS 78835-00-4) is a chemical compound with molecular formula C19H24O3 and molecular weight 300.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-羟基-3,5-二异戊烯基肉桂酸
3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-enoic acid
Also Known As: Artepillin C, 4-hydroxy-3,5-diprenylcinnamic acid, NCI60_040915, 3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-enoic acid, 2-Propenoic acid, 3-[4-hydroxy-3,5-bis(3-methyl-2-butenyl)phenyl]-
| Molecular Formula | C19H24O3 |
|---|---|
| Molecular Weight | 300.17 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 300.17255 |
| Heavy Atoms | 22 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 78835-00-4 |
|---|---|
| SMILES | CC(=CCC1=CC(=CC(=C1O)CC=C(C)C)C=CC(=O)O)C |
| InChIKey | KABCFARPAMSXCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-羟基-3,5-二异戊烯基肉桂酸 (CAS 78835-00-4), with molecular formula C19H24O3 and molecular weight 300.17 g/mol. IUPAC: 3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-enoic acid.
Chemical Property Profile of 4-羟基-3,5-二异戊烯基肉桂酸
Property Insights of 4-羟基-3,5-二异戊烯基肉桂酸
The XLogP value of 5.4 indicates that 4-羟基-3,5-二异戊烯基肉桂酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 4-羟基-3,5-二异戊烯基肉桂酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-羟基-3,5-二异戊烯基肉桂酸 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-羟基-3,5-二异戊烯基肉桂酸?
The CAS number of 4-羟基-3,5-二异戊烯基肉桂酸 is 78835-00-4.
What is the molecular formula of 4-羟基-3,5-二异戊烯基肉桂酸?
The molecular formula of 4-羟基-3,5-二异戊烯基肉桂酸 is C19H24O3.
What is the molecular weight of 4-羟基-3,5-二异戊烯基肉桂酸?
The molecular weight of 4-羟基-3,5-二异戊烯基肉桂酸 is 300.17 g/mol.
Where can I buy 4-羟基-3,5-二异戊烯基肉桂酸?
You can request a quote for 4-羟基-3,5-二异戊烯基肉桂酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-羟基-3,5-二异戊烯基肉桂酸?
Yes, KEHONG BIO provides custom synthesis services for 4-羟基-3,5-二异戊烯基肉桂酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.