3-Methoxy-2-nitroaniline - CAS 16554-47-5
Catalog: |
BB012197 |
Product Name: |
3-Methoxy-2-nitroaniline |
CAS: |
16554-47-5 |
Synonyms: |
3-methoxy-2-nitroaniline; 3-methoxy-2-nitroaniline |
IUPAC Name: | 3-methoxy-2-nitroaniline |
Description: | 3-Methoxy-2-nitroaniline (CAS# 16554-47-5) is a useful research chemical. |
Molecular Weight: | 168.15 |
Molecular Formula: | C7H8N2O3 |
Canonical SMILES: | COC1=CC=CC(=C1[N+](=O)[O-])N |
InChI: | InChI=1S/C7H8N2O3/c1-12-6-4-2-3-5(8)7(6)9(10)11/h2-4H,8H2,1H3 |
InChI Key: | RITQAMSEQYWFML-UHFFFAOYSA-N |
LogP: | 2.29000 |
Publication Number | Title | Priority Date |
CN-111116496-A | Synthetic method of quinoxaline heterocyclic derivative | 20191227 |
WO-2021066123-A1 | Metal complex and electron transporting material comprising same | 20191002 |
CA-2799817-A1 | Inhibitors of jnk | 20100604 |
EP-2576559-A1 | Inhibitors of jnk | 20100604 |
EP-2576559-B1 | Inhibitors of jnk | 20100604 |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.05349212 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.05349212 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 81.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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