![3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid structure](/static/products/2180/21800-49-7.webp)
3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid
TL;DR: 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid (CAS 21800-49-7) is a chemical compound with molecular formula C24H28O5 and molecular weight 396.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1R,2R,6R)-1,3-dimethyl-2-[(2-oxochromen-7-yl)oxymethyl]-6-prop-1-en-2-ylcyclohex-3-en-1-yl]propanoic acid
Also Known As: 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid, 3-[(1R,2R,6R)-1,3-dimethyl-2-[(2-oxochromen-7-yl)oxymethyl]-6-prop-1-en-2-ylcyclohex-3-en-1-yl]propanoic acid, 3-[1,3-dimethyl-2-[(2-oxochromen-7-yl)oxymethyl]-6-prop-1-en-2-yl-1-cyclohex-3-enyl]propanoic Acid
| Molecular Formula | C24H28O5 |
|---|---|
| Molecular Weight | 396.19 g/mol |
| LogP | 5.2014 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.19366 |
| Heavy Atoms | 29 |
| Complexity | 1015.34814 |
Chemical Identifiers
| CAS Number | 21800-49-7 |
|---|---|
| SMILES | CC1=CC[C@@H]([C@@]([C@@H]1COC2=CC3=C(C=C2)C=CC(=O)O3)(C)CCC(=O)O)C(=C)C |
Product Overview
3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid (CAS 21800-49-7), with molecular formula C24H28O5 and molecular weight 396.19 g/mol. IUPAC: 3-[(1R,2R,6R)-1,3-dimethyl-2-[(2-oxochromen-7-yl)oxymethyl]-6-prop-1-en-2-ylcyclohex-3-en-1-yl]propanoic acid.
Chemical Property Profile of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid
Property Insights of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid
The XLogP value of 5.2014 indicates that 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid. Following Lipinski's Rule of Five, 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid?
The CAS number of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid is 21800-49-7.
What is the molecular formula of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid?
The molecular formula of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid is C24H28O5.
What is the molecular weight of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid?
The molecular weight of 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid is 396.19 g/mol.
Where can I buy 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid?
You can request a quote for 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid?
Yes, KEHONG BIO provides custom synthesis services for 3-[-6-isopropenyl-1,3-dimethyl-2-cyclohex-3-enyl]-propionicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.