Benzoic acid, p-nitro-, cyclopentylidenehydrazide
TL;DR: Benzoic acid, p-nitro-, cyclopentylidenehydrazide (CAS 329-83-9) is a chemical compound with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyclopentylideneamino)-4-nitrobenzamide
Also Known As: Secoxyloganin, 2-Bromobenzotrifluoride, N-(cyclopentylideneamino)-4-nitrobenzamide, N'-cyclopentylidene-4-nitrobenzohydrazide, BENZOIC ACID, p-NITRO-, CYCLOPENTYLIDENEHYDRAZIDE
| Molecular Formula | C12H13N3O3 |
|---|---|
| Molecular Weight | 247.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 87.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.09569 |
| Heavy Atoms | 18 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 329-83-9 |
|---|---|
| SMILES | C1CCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C1 |
| InChIKey | QVSXYVVAOWEMJV-UHFFFAOYSA-N |
Product Overview
Benzoic acid, p-nitro-, cyclopentylidenehydrazide (CAS 329-83-9), with molecular formula C12H13N3O3 and molecular weight 247.10 g/mol. IUPAC: N-(cyclopentylideneamino)-4-nitrobenzamide.
Chemical Property Profile of Benzoic acid, p-nitro-, cyclopentylidenehydrazide
Property Insights of Benzoic acid, p-nitro-, cyclopentylidenehydrazide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, p-nitro-, cyclopentylidenehydrazide. The TPSA of 87.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, p-nitro-, cyclopentylidenehydrazide. Following Lipinski's Rule of Five, Benzoic acid, p-nitro-, cyclopentylidenehydrazide has 1 hydrogen bond donor(s) and 4 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 Benzoic acid, p-nitro-, cyclopentylidenehydrazide?
The CAS number of Benzoic acid, p-nitro-, cyclopentylidenehydrazide is 329-83-9.
What is the molecular formula of Benzoic acid, p-nitro-, cyclopentylidenehydrazide?
The molecular formula of Benzoic acid, p-nitro-, cyclopentylidenehydrazide is C12H13N3O3.
What is the molecular weight of Benzoic acid, p-nitro-, cyclopentylidenehydrazide?
The molecular weight of Benzoic acid, p-nitro-, cyclopentylidenehydrazide is 247.10 g/mol.
Where can I buy Benzoic acid, p-nitro-, cyclopentylidenehydrazide?
You can request a quote for Benzoic acid, p-nitro-, cyclopentylidenehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, p-nitro-, cyclopentylidenehydrazide?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, p-nitro-, cyclopentylidenehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.