3-(1-Nitrocyclohexyl)propanoic acid
TL;DR: 3-(1-Nitrocyclohexyl)propanoic acid (CAS 77739-72-1) is a chemical compound with molecular formula C9H15NO4 and molecular weight 201.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1-nitrocyclohexyl)propanoic acid
Also Known As: 3-(1-nitrocyclohexyl)propanoic acid, cyclohexanepropanoic acid, 1-nitro-, CHEMBRDG-BB5345383, CHEMBRDG-BB 5345383, 3-(1-Nitrocyclohexyl)propanoicacid
| Molecular Formula | C9H15NO4 |
|---|---|
| Molecular Weight | 201.10 g/mol |
| LogP | 1.8308 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 201.10011 |
| Heavy Atoms | 14 |
| Complexity | 232.96645 |
Chemical Identifiers
| CAS Number | 77739-72-1 |
|---|---|
| SMILES | C1CCC(CC1)(CCC(=O)O)[N+](=O)[O-] |
Product Overview
3-(1-Nitrocyclohexyl)propanoic acid (CAS 77739-72-1), with molecular formula C9H15NO4 and molecular weight 201.10 g/mol. IUPAC: 3-(1-nitrocyclohexyl)propanoic acid.
Chemical Property Profile of 3-(1-Nitrocyclohexyl)propanoic acid
Property Insights of 3-(1-Nitrocyclohexyl)propanoic acid
The XLogP value of 1.8308 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Nitrocyclohexyl)propanoic acid. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1-Nitrocyclohexyl)propanoic acid. Following Lipinski's Rule of Five, 3-(1-Nitrocyclohexyl)propanoic acid 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 3-(1-Nitrocyclohexyl)propanoic acid?
The CAS number of 3-(1-Nitrocyclohexyl)propanoic acid is 77739-72-1.
What is the molecular formula of 3-(1-Nitrocyclohexyl)propanoic acid?
The molecular formula of 3-(1-Nitrocyclohexyl)propanoic acid is C9H15NO4.
What is the molecular weight of 3-(1-Nitrocyclohexyl)propanoic acid?
The molecular weight of 3-(1-Nitrocyclohexyl)propanoic acid is 201.10 g/mol.
Where can I buy 3-(1-Nitrocyclohexyl)propanoic acid?
You can request a quote for 3-(1-Nitrocyclohexyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Nitrocyclohexyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Nitrocyclohexyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.