![2-[(3-硝基苯基)亚甲基氨基]苯甲酸 structure](/static/products/4202/42027-58-7.webp)
2-[(3-硝基苯基)亚甲基氨基]苯甲酸
TL;DR: 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 (CAS 42027-58-7) is a chemical compound with molecular formula C14H10N2O4 and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-硝基苯基)亚甲基氨基]苯甲酸
2-[(3-nitrophenyl)methylideneamino]benzoic acid
Also Known As: 2-[(3-nitrophenyl)methylideneamino]benzoic acid, 3-nitrobenzylidene-2-aminobenzoic acid, J3.589.167F, (z)-2-((3-nitrobenzylidene)amino)benzoic acid, 2-[[(Z)-3-Nitrobenzylidene]amino]benzoic acid
| Molecular Formula | C14H10N2O4 |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.06406 |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 42027-58-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)N=CC2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | FSWKLPOFUIMIFP-UHFFFAOYSA-N |
Product Overview
2-[(3-硝基苯基)亚甲基氨基]苯甲酸 (CAS 42027-58-7), with molecular formula C14H10N2O4 and molecular weight 270.06 g/mol. IUPAC: 2-[(3-nitrophenyl)methylideneamino]benzoic acid.
Chemical Property Profile of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸
Property Insights of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-硝基苯基)亚甲基氨基]苯甲酸. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-硝基苯基)亚甲基氨基]苯甲酸. Following Lipinski's Rule of Five, 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 has 1 hydrogen bond donor(s) and 5 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 2-[(3-硝基苯基)亚甲基氨基]苯甲酸?
The CAS number of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 is 42027-58-7.
What is the molecular formula of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸?
The molecular formula of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 is C14H10N2O4.
What is the molecular weight of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸?
The molecular weight of 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 is 270.06 g/mol.
Where can I buy 2-[(3-硝基苯基)亚甲基氨基]苯甲酸?
You can request a quote for 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3-硝基苯基)亚甲基氨基]苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3-硝基苯基)亚甲基氨基]苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.