7-Fluoro-2,3-dihydro-1,4-benzodioxin-5-amine - CAS 698985-54-5
Catalog: |
BB065374 |
Product Name: |
7-Fluoro-2,3-dihydro-1,4-benzodioxin-5-amine |
CAS: |
698985-54-5 |
Synonyms: |
7-Fluoro-2,3-dihydro-1,4-benzodioxin-5-amine; 7-fluoro-2,3-dihydrobenzo[b][1,4]dioxin-5-amine |
IUPAC Name: | 7-fluoro-2,3-dihydro-1,4-benzodioxin-5-amine |
Molecular Weight: | 169.15 |
Molecular Formula: | C8H8FNO2 |
Canonical SMILES: | C1COC2=C(C=C(C=C2O1)F)N |
InChI: | InChI=1S/C8H8FNO2/c9-5-3-6(10)8-7(4-5)11-1-2-12-8/h3-4H,1-2,10H2 |
InChI Key: | XBTOBDYFBPMYJD-UHFFFAOYSA-N |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.05390666 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.05390666 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 44.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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