5-(4-Fluoro-3-nitrophenyl)-2H-tetrazole - CAS 328244-35-5
Catalog: |
BB021427 |
Product Name: |
5-(4-Fluoro-3-nitrophenyl)-2H-tetrazole |
CAS: |
328244-35-5 |
Synonyms: |
5-(4-fluoro-3-nitrophenyl)-2H-tetrazole; 5-(4-fluoro-3-nitrophenyl)-2H-tetrazole |
IUPAC Name: | 5-(4-fluoro-3-nitrophenyl)-2H-tetrazole |
Description: | 5-(4-Fluoro-3-nitrophenyl)-2H-tetrazole (CAS# 328244-35-5) is a useful research chemical. |
Molecular Weight: | 209.14 |
Molecular Formula: | C7H4FN5O2 |
Canonical SMILES: | C1=CC(=C(C=C1C2=NNN=N2)[N+](=O)[O-])F |
InChI: | InChI=1S/C7H4FN5O2/c8-5-2-1-4(3-6(5)13(14)15)7-9-11-12-10-7/h1-3H,(H,9,10,11,12) |
InChI Key: | YUJQZCDGMQSNKW-UHFFFAOYSA-N |
LogP: | 2.24950 |
Publication Number | Title | Priority Date |
WO-2020104822-A1 | Compounds | 20181123 |
CN-113056305-A | Compound (I) | 20181123 |
EP-3883650-A1 | Compounds | 20181123 |
KR-20210095647-A | compound | 20181123 |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.03490255 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.03490255 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 100 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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