Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)
TL;DR: Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) (CAS 10061-22-0) is a chemical compound with molecular formula C8H8N2O5 and molecular weight 212.04332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-nitrophenyl)ethyl nitrate
Also Known As: 1-(4-nitrophenyl)ethyl nitrate, 1-(p-Nitrophenyl)ethyl nitrate, 3-(4-nitrophenyl)ethyl nitrate, 1-Nitro-4-[1-(nitrooxy)ethyl]benzene, alpha-Methyl-4-nitrobenzyl=nitrate
Technical Specifications
| Molecular Formula | C8H8N2O5 |
| Molecular Weight | 212.04332 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.04332 Da |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
| SMILES | CC(C1=CC=C(C=C1)[N+](=O)[O-])O[N+](=O)[O-] |
| InChIKey | QFPAMHKBIYSCKR-UHFFFAOYSA-N |
Chemical Property Profile of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)
Property Insights of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester). The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester). Following Lipinski's Rule of Five, Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)?
The CAS number of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) is 10061-22-0.
What is the molecular formula of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)?
The molecular formula of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) is C8H8N2O5.
What is the molecular weight of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)?
The molecular weight of Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) is 212.04332 g/mol.
Where can I buy Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)?
You can request a quote for Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester)?
Yes, CoreyChem provides custom synthesis services for Benzyl alcohol, alpha-methyl-p-nitro-, nitrate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.