1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-
TL;DR: 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- (CAS 55252-88-5) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-carboxy-3-methylbut-3-enyl)-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid
Also Known As: 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-, 5-(4-Carboxy-3-methyl-3-buten-1-yl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-1-naphthalenecarboxylic acid, 5-(4-carboxy-3-methylbut-3-en-1-yl)-5,6,8a-trimethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid
| Molecular Formula | C20H30O4 |
|---|---|
| Molecular Weight | 334.21 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.21442 |
| Heavy Atoms | 24 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 55252-88-5 |
|---|---|
| SMILES | CC1CCC2(C(C1(C)CCC(=CC(=O)O)C)CCC=C2C(=O)O)C |
| InChIKey | FMWSHZRIJXQMOO-UHFFFAOYSA-N |
Product Overview
1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- (CAS 55252-88-5), with molecular formula C20H30O4 and molecular weight 334.21 g/mol. IUPAC: 5-(4-carboxy-3-methylbut-3-enyl)-5,6,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-1-carboxylic acid.
Chemical Property Profile of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-
Property Insights of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-
The XLogP value of 5.5 indicates that 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-. Following Lipinski's Rule of Five, 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- has 2 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 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-?
The CAS number of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- is 55252-88-5.
What is the molecular formula of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-?
The molecular formula of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- is C20H30O4.
What is the molecular weight of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-?
The molecular weight of 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- is 334.21 g/mol.
Where can I buy 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-?
You can request a quote for 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthalenecarboxylic acid, 5-(4-carboxy-3-methyl-3-butenyl)-3,4,4a,5,6,7,8,8a-octahydro-5,6,8a-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.