脱落酸
TL;DR: 脱落酸 (CAS 21293-29-8) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
脱落酸
5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
Also Known As: (+)-Abscisic acid, ABSCISIC ACID, (+)-cis,trans-Abscisic Acid, (2Z,4E)-5-((S)-1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid, (s)-5-(1-hydroxy-2,6,6-trimethyl-4-oxo-2-cyclohexen-1-yl)-3-methyl-2,4-pentanedienoic acid
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 21293-29-8 |
|---|---|
| SMILES | CC1=CC(=O)CC([C@]1(C=CC(=CC(=O)O)C)O)(C)C |
| InChIKey | JLIDBLDQVAYHNE-OAHLLOKOSA-N |
Product Overview
脱落酸 (CAS 21293-29-8), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: 5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid.
Chemical Property Profile of 脱落酸
Property Insights of 脱落酸
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 脱落酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 脱落酸. Following Lipinski's Rule of Five, 脱落酸 has 2 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 脱落酸?
The CAS number of 脱落酸 is 21293-29-8.
What is the molecular formula of 脱落酸?
The molecular formula of 脱落酸 is C15H20O4.
What is the molecular weight of 脱落酸?
The molecular weight of 脱落酸 is 264.14 g/mol.
Where can I buy 脱落酸?
You can request a quote for 脱落酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 脱落酸?
Yes, KEHONG BIO provides custom synthesis services for 脱落酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.