1-Heptanol, 7-nitro-
TL;DR: 1-Heptanol, 7-nitro- (CAS 133088-94-5) is a chemical compound with molecular formula C7H15NO3 and molecular weight 161.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-nitroheptan-1-ol
Also Known As: 7-nitroheptan-1-ol, 1-Heptanol, 7-nitro-, 7-nitro-1-heptanol, 1-Heptanol,7-nitro
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H15NO3 |
| Molecular Weight | 161.1052 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 161.1052 Da |
| Heavy Atoms | 11 |
| Complexity | 100.0 |
| SMILES | C(CCC[N+](=O)[O-])CCCO |
| InChIKey | NSQGVCPOJCWINW-UHFFFAOYSA-N |
Chemical Property Profile of 1-Heptanol, 7-nitro-
Property Insights of 1-Heptanol, 7-nitro-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Heptanol, 7-nitro-. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Heptanol, 7-nitro-. Following Lipinski's Rule of Five, 1-Heptanol, 7-nitro- 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
What is the CAS number of 1-Heptanol, 7-nitro-?
The CAS number of 1-Heptanol, 7-nitro- is 133088-94-5.
What is the molecular formula of 1-Heptanol, 7-nitro-?
The molecular formula of 1-Heptanol, 7-nitro- is C7H15NO3.
What is the molecular weight of 1-Heptanol, 7-nitro-?
The molecular weight of 1-Heptanol, 7-nitro- is 161.1052 g/mol.
Where can I buy 1-Heptanol, 7-nitro-?
You can request a quote for 1-Heptanol, 7-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Heptanol, 7-nitro-?
Yes, CoreyChem provides custom synthesis services for 1-Heptanol, 7-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.