4'-Methoxy-3'-nitroacetophenone - CAS 6277-38-9
Catalog: |
BB031791 |
Product Name: |
4'-Methoxy-3'-nitroacetophenone |
CAS: |
6277-38-9 |
Synonyms: |
1-(4-methoxy-3-nitrophenyl)ethanone |
IUPAC Name: | 1-(4-methoxy-3-nitrophenyl)ethanone |
Description: | 4'-Methoxy-3'-nitroacetophenone (CAS# 6277-38-9) is a useful research chemical. |
Molecular Weight: | 195.17 |
Molecular Formula: | C9H9NO4 |
Canonical SMILES: | CC(=O)C1=CC(=C(C=C1)OC)[N+](=O)[O-] |
InChI: | InChI=1S/C9H9NO4/c1-6(11)7-3-4-9(14-2)8(5-7)10(12)13/h3-5H,1-2H3 |
InChI Key: | VXLKYQQBEPCMJE-UHFFFAOYSA-N |
Boiling Point: | 315.1 ℃ at 760 mmHg |
Purity: | 98+ % |
Density: | 1.244 g/cm3 |
MDL: | MFCD00017023 |
LogP: | 2.32920 |
Publication Number | Title | Priority Date |
BR-112019018770-A2 | 2-aminoimidazole-phenyl derivatives useful to control microbial growth | 20170315 |
CN-110740645-A | 2-aminoimidazole-phenyl derivatives for controlling microbial growth | 20170315 |
JP-2020514417-A | 2-Aminoimidazole-phenyl derivative useful for suppressing microbial growth | 20170315 |
KR-20190129072-A | 2-aminoimidazole-phenyl derivatives useful for controlling growth of microorganisms | 20170315 |
US-2020002329-A1 | Class of bifunctional compounds with quanternary ammonium salt structure | 20161214 |
Complexity: | 236 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.05315777 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 72.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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