[3-(3-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine - CAS 937651-13-3
Catalog: |
BB065124 |
Product Name: |
[3-(3-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine |
CAS: |
937651-13-3 |
Synonyms: |
[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine; (3-(3-FLUOROPHENYL)-1,2,4-OXADIAZOL-5-YL)METHANAMINE |
IUPAC Name: | [3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine |
Description: | [3-(3-Fluorophenyl)-1,2,4-oxadiazol-5-yl]methanamine |
Molecular Weight: | 193.18 |
Molecular Formula: | C9H8FN3O |
Canonical SMILES: | C1=CC(=CC(=C1)F)C2=NOC(=N2)CN |
InChI: | InChI=1S/C9H8FN3O/c10-7-3-1-2-6(4-7)9-12-8(5-11)14-13-9/h1-4H,5,11H2 |
InChI Key: | IMPZJQKVXUVXRN-UHFFFAOYSA-N |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.06514005 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.06514005 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 64.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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