N-Cyclopropyl-5-fluoro-2-nitroaniline - CAS 1248276-34-7
Catalog: |
BB069066 |
Product Name: |
N-Cyclopropyl-5-fluoro-2-nitroaniline |
CAS: |
1248276-34-7 |
Synonyms: |
N-Cyclopropyl-5-fluoro-2-nitroaniline; Cyclopropyl-(5-fluoro-2-nitrophenyl)amine |
IUPAC Name: | N-cyclopropyl-5-fluoro-2-nitroaniline |
Description: | N-Cyclopropyl-5-fluoro-2-nitroaniline |
Molecular Weight: | 196.18 |
Molecular Formula: | C9H9FN2O2 |
Canonical SMILES: | C1CC1NC2=C(C=CC(=C2)F)[N+](=O)[O-] |
InChI: | InChI=1S/C9H9FN2O2/c10-6-1-4-9(12(13)14)8(5-6)11-7-2-3-7/h1,4-5,7,11H,2-3H2 |
InChI Key: | GHQAEBACHMXJQB-UHFFFAOYSA-N |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.0648057 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.0648057 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 57.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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