2-Chloro-4-fluoro-6-nitroaniline - CAS 153505-32-9
Catalog: |
BB070350 |
Product Name: |
2-Chloro-4-fluoro-6-nitroaniline |
CAS: |
153505-32-9 |
Synonyms: |
2-chloro-4-fluoro-6-nitroaniline |
IUPAC Name: | 2-chloro-4-fluoro-6-nitroaniline |
Description: | 2-Chloro-4-fluoro-6-nitroaniline |
Molecular Weight: | 190.56 |
Molecular Formula: | C6H4ClFN2O2 |
Canonical SMILES: | C1=C(C=C(C(=C1[N+](=O)[O-])N)Cl)F |
InChI: | InChI=1S/C6H4ClFN2O2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H,9H2 |
InChI Key: | COJJQULUJYCZEP-UHFFFAOYSA-N |
Complexity: | 187 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.9945332 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.9945332 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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