rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile
TL;DR: rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile (CAS 125291-55-6) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
cis-(1S,2R)-2-hydroxycyclohexane-1-carbonitrile
Also Known As: trans-2-Cyano-1-cyclohexanol, (1S,2R)-2-Hydroxycyclohexanecarbonitrile, trans-2-Hydroxycyclohexanecarbonitrile, (1S,2R)-2-hydroxycyclohexane-1-carbonitrile, trans-2-cyano-cyclohexanol
Technical Specifications
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.08406 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.08406 Da |
| Heavy Atoms | 9 |
| Complexity | 135.0 |
| SMILES | C1CC[C@H]([C@@H](C1)C#N)O |
| InChIKey | MFPCXQNVYPKUSM-NKWVEPMBSA-N |
Chemical Property Profile of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile
Property Insights of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile. With a topological polar surface area (TPSA) of 44.0 Ų, rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile?
The CAS number of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile is 125291-55-6.
What is the molecular formula of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile?
The molecular formula of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile is C7H11NO.
What is the molecular weight of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile?
The molecular weight of rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile is 125.08406 g/mol.
Where can I buy rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile?
You can request a quote for rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile?
Yes, CoreyChem provides custom synthesis services for rac-(1R,2S)-2-hydroxycyclohexane-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.