2-Methyl-4-nitroanisole - CAS 50741-92-9
Catalog: |
BB027203 |
Product Name: |
2-Methyl-4-nitroanisole |
CAS: |
50741-92-9 |
Synonyms: |
1-methoxy-2-methyl-4-nitrobenzene |
IUPAC Name: | 1-methoxy-2-methyl-4-nitrobenzene |
Description: | 2-Methyl-4-nitroanisole (CAS# 50741-92-9) is a compound useful in organic synthesis. |
Molecular Weight: | 167.16 |
Molecular Formula: | C8H9NO3 |
Canonical SMILES: | CC1=C(C=CC(=C1)[N+](=O)[O-])OC |
InChI: | InChI=1S/C8H9NO3/c1-6-5-7(9(10)11)3-4-8(6)12-2/h3-5H,1-2H3 |
InChI Key: | QOZMIJZYJZQOBV-UHFFFAOYSA-N |
Boiling Point: | 283 ℃ at 760 mmHg |
Density: | 1.18 g/cm3 |
Appearance: | Off-white solid |
LogP: | 2.43500 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020230134-A1 | Acss2 inhibitors and methods of use thereof | 20190514 |
US-2020298212-A1 | Iron oxide supported rhodium catalyst for nitroarene reduction | 20190320 |
WO-2019025153-A1 | USE OF SUBSTITUTED N-SULFONYL-N'-ARYLDIAMINOALKANES AND N-SULFONYL-N'-HETEROARYL DIAMINOALKANES OR THEIR SALTS TO INCREASE STRESSTOLERANCE IN PLANTS | 20170731 |
US-2018185403-A1 | Methods of diagnosing and treating cancer | 20161223 |
US-2018099962-A1 | Naphthyridine compounds, medical combinations and use thereof | 20161009 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 167.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 167.058243149 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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