5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile
TL;DR: 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile (CAS 7233-21-8) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile
Also Known As: 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile, 5-Hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4,4a,5,6,7,8-hexahydronaphthalene-2-carbonitrile
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 2.31458 |
| Topological Polar Surface Area | 64.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 446.0945 |
Chemical Identifiers
| CAS Number | 7233-21-8 |
|---|---|
| SMILES | CC1(CCCC2=CC(=CC(C21)C(C)(C)O)C#N)O |
Product Overview
5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile (CAS 7233-21-8), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile.
Chemical Property Profile of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile
Property Insights of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile
The XLogP value of 2.31458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile. The TPSA of 64.25 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile. Following Lipinski's Rule of Five, 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile has 2 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 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile?
The CAS number of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile is 7233-21-8.
What is the molecular formula of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile?
The molecular formula of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile is C15H21NO2.
What is the molecular weight of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile?
The molecular weight of 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile is 247.16 g/mol.
Where can I buy 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile?
You can request a quote for 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-hydroxy-4-(2-hydroxypropan-2-yl)-5-methyl-4a,6,7,8-tetrahydro-4H-naphthalene-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.