2-Amino-4-nitro-5-methoxybenzoic Acid - CAS 196194-99-7
Catalog: |
BB015188 |
Product Name: |
2-Amino-4-nitro-5-methoxybenzoic Acid |
CAS: |
196194-99-7 |
Synonyms: |
2-amino-5-methoxy-4-nitrobenzoic acid; 2-amino-5-methoxy-4-nitrobenzoic acid |
IUPAC Name: | 2-amino-5-methoxy-4-nitrobenzoic acid |
Description: | 2-Amino-4-nitro-5-methoxybenzoic Acid (CAS# 196194-99-7) is a useful research chemical. |
Molecular Weight: | 212.16 |
Molecular Formula: | C8H8N2O5 |
Canonical SMILES: | COC1=C(C=C(C(=C1)C(=O)O)N)[N+](=O)[O-] |
InChI: | InChI=1S/C8H8N2O5/c1-15-7-2-4(8(11)12)5(9)3-6(7)10(13)14/h2-3H,9H2,1H3,(H,11,12) |
InChI Key: | SDGOTDAQMBDEOT-UHFFFAOYSA-N |
Boiling Point: | 470.8 °C at 760 mmHg |
Density: | 1.514 g/cm3 |
LogP: | 1.98820 |
Publication Number | Title | Priority Date |
MX-2007001135-A | DERIVATIVES OF QUINAZOLINA. | 20040727 |
AU-2003281027-A1 | Urea-substituted and urethane-substituted acylureas, methods for the production thereof and their use as medicaments | 20020711 |
CA-2493373-A1 | Urea-substituted and urethane-substituted acylureas, methods for the production thereof and their use as medicaments | 20020711 |
EP-1523471-A1 | Urea-substituted and urethane-substituted acylureas, methods for the production thereof and their use as medicaments | 20020711 |
EP-1523471-B1 | Urea-substituted and urethane-substituted acylureas, methods for the production thereof and their use as medicaments | 20020711 |
Complexity: | 264 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 212.04332136 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 212.04332136 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 118 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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