3-Fluoro-6-methyl-2-nitropyridine - CAS 247077-46-9
Catalog: |
BB018591 |
Product Name: |
3-Fluoro-6-methyl-2-nitropyridine |
CAS: |
247077-46-9 |
Synonyms: |
3-fluoro-6-methyl-2-nitropyridine; 3-fluoro-6-methyl-2-nitropyridine |
IUPAC Name: | 3-fluoro-6-methyl-2-nitropyridine |
Description: | 3-Fluoro-6-methyl-2-nitropyridine (CAS# 247077-46-9) is a heterocyclic synthetic intermediate. |
Molecular Weight: | 156.11 |
Molecular Formula: | C6H5FN2O2 |
Canonical SMILES: | CC1=NC(=C(C=C1)F)[N+](=O)[O-] |
InChI: | InChI=1S/C6H5FN2O2/c1-4-2-3-5(7)6(8-4)9(10)11/h2-3H,1H3 |
InChI Key: | GJGUXNSOQFTBGB-UHFFFAOYSA-N |
LogP: | 1.96050 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-H11292877-A | 1,4-disubstituted pyridopyrazine derivatives | 19980409 |
Complexity: | 159 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.03350557 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.03350557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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