7-Fluoro-2,3,4,5-tetrahydro-1H-3-benzazepine - CAS 324558-64-7
Catalog: |
BB063429 |
Product Name: |
7-Fluoro-2,3,4,5-tetrahydro-1H-3-benzazepine |
CAS: |
324558-64-7 |
Synonyms: |
7-fluoro-2,3,4,5-tetrahydro-1H-3-benzazepine; 7-fluoro-2,3,4,5-tetrahydro-1H-benzo[d]azepine; 1H-3-Benzazepine,7-fluoro-2,3,4,5-tetrahydro-(9CI); 1H-?3-?Benzazepine, 7-?fluoro-?2,?3,?4,?5-?tetrahydro- |
IUPAC Name: | 7-fluoro-2,3,4,5-tetrahydro-1H-3-benzazepine |
Molecular Weight: | 165.21 |
Molecular Formula: | C10H12FN |
Canonical SMILES: | C1CNCCC2=C1C=CC(=C2)F |
InChI: | InChI=1S/C10H12FN/c11-10-2-1-8-3-5-12-6-4-9(8)7-10/h1-2,7,12H,3-6H2 |
InChI Key: | SHDMCTOVONAMKO-UHFFFAOYSA-N |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.095377549 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.095377549 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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