N-Ethyl-2,3-difluoro-6-nitroaniline - CAS 1248209-18-8
Catalog: |
BB063299 |
Product Name: |
N-Ethyl-2,3-difluoro-6-nitroaniline |
CAS: |
1248209-18-8 |
Synonyms: |
N-Ethyl-2,3-difluoro-6-nitroaniline |
IUPAC Name: | N-ethyl-2,3-difluoro-6-nitroaniline |
Description: | N-Ethyl-2,3-difluoro-6-nitroaniline |
Molecular Weight: | 202.16 |
Molecular Formula: | C8H8F2N2O2 |
Canonical SMILES: | CCNC1=C(C=CC(=C1F)F)[N+](=O)[O-] |
InChI: | InChI=1S/C8H8F2N2O2/c1-2-11-8-6(12(13)14)4-3-5(9)7(8)10/h3-4,11H,2H2,1H3 |
InChI Key: | OQZJPLHCMMMQOV-UHFFFAOYSA-N |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.05538383 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.05538383 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 57.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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