2-Fluoro-4-nitroanisole - CAS 455-93-6
Catalog: |
BB025940 |
Product Name: |
2-Fluoro-4-nitroanisole |
CAS: |
455-93-6 |
Synonyms: |
2-fluoro-1-methoxy-4-nitrobenzene |
IUPAC Name: | 2-fluoro-1-methoxy-4-nitrobenzene |
Description: | 2-Fluoro-4-nitroanisole (CAS# 455-93-6) is a useful research chemical. |
Molecular Weight: | 171.13 |
Molecular Formula: | C7H6FNO3 |
Canonical SMILES: | COC1=C(C=C(C=C1)[N+](=O)[O-])F |
InChI: | InChI=1S/C7H6FNO3/c1-12-7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3 |
InChI Key: | XGMVTXUXZUPGGY-UHFFFAOYSA-N |
Boiling Point: | 277.2 °C at 760 mmHg |
Melting Point: | 103-105 °C |
Purity: | 98 % |
Density: | 1.321 g/cm3 |
Appearance: | White to light yellow crystalline powder |
MDL: | MFCD00061095 |
LogP: | 2.26570 |
GHS Hazard Statement: | H315 (91.11%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
KR-102147990-B1 | Polyurea waterproof agent and manufacturing method thereof and excellent thermo shield function waterproof method using thereof | 20200224 |
KR-20180133906-A | Amine-substituted aryl or heteroaryl compounds as EHMT1 and EHMT2 inhibitors | 20160415 |
CA-3012074-A1 | Organic reactions carried out in aqueous solution in the presence of a hydroxyalkyl(alkyl)cellulose or an alkylcellulose | 20160129 |
CN-109071446-A | The organic reaction carried out in aqueous solution in the presence of hydroxy alkyl (alkyl) cellulose or alkylcellulose | 20160129 |
EP-3408258-A1 | Organic reactions carried out in aqueous solution in the presence of a hydroxyalkyl(alkyl)cellulose or an alkylcellulose | 20160129 |
PMID | Publication Date | Title | Journal |
18215066 | 20080307 | The element effect and nucleophilicity in nucleophilic aromatic photosubstitution (SN2Ar*). Local atom effects as mechanistic probes of very fast reactions | The Journal of organic chemistry |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.03317122 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.03317122 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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