1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-
TL;DR: 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- (CAS 1120-32-7) is a chemical compound with molecular formula C20H34O3 and molecular weight 322.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R,4aR,5R,8aR)-5-(5-hydroxy-3-methylpentyl)-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate
Also Known As: 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-, 1-Naphthalenecarboxylicacid, decahydro-5-[(3S)-5-hydroxy-3-methylpentyl]-1,4a-dimethyl-6-methylene-,(1R,4aS,5R,8aS)-, methyl (1R,4aR,5R,8aR)-5-(5-hydroxy-3-methylpentyl)-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate, methyl (1R,4aR,5R,8aR)-5-(5-hydroxy-3-methylpentyl)-4a-methyl-6-methylidenedecahydronaphthalene-1-carboxylate, Methyl 5-(5-hydroxy-3-methylpentyl)-4a-methyl-6-methylidenedecahydronaphthalene-1-carboxylate
| Molecular Formula | C20H34O3 |
|---|---|
| Molecular Weight | 322.25 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 322.2508 |
| Heavy Atoms | 23 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 1120-32-7 |
|---|---|
| SMILES | CC(CC[C@@H]1C(=C)CC[C@H]2[C@]1(CCC[C@H]2C(=O)OC)C)CCO |
| InChIKey | ONJMNGIMDPWSGO-CNHWCMRISA-N |
Product Overview
1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- (CAS 1120-32-7), with molecular formula C20H34O3 and molecular weight 322.25 g/mol. IUPAC: methyl (1R,4aR,5R,8aR)-5-(5-hydroxy-3-methylpentyl)-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate.
Chemical Property Profile of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-
Property Insights of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-
The XLogP value of 4.9 indicates that 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- has 1 hydrogen bond donor(s) and 3 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 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-?
The CAS number of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- is 1120-32-7.
What is the molecular formula of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-?
The molecular formula of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- is C20H34O3.
What is the molecular weight of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-?
The molecular weight of 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- is 322.25 g/mol.
Where can I buy 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-?
You can request a quote for 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- 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, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Naphthalenecarboxylic acid, decahydro-5-((3S)-5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylene-, (1R,4aS,5R,8aS)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.