1-(3-Fluoro-4-pyrrolidin-1-ylphenyl)ethanone - CAS 385380-85-8
Catalog: |
BB065090 |
Product Name: |
1-(3-Fluoro-4-pyrrolidin-1-ylphenyl)ethanone |
CAS: |
385380-85-8 |
Synonyms: |
1-(3-fluoro-4-pyrrolidin-1-ylphenyl)ethanone; 1-(3-Fluoro-4-(pyrrolidin-1-yl)phenyl)ethanone; 1-[3-fluoro-4-(pyrrolidin-1-yl)phenyl]ethan-1-one; 1-[3-fluoro-4-(pyrrolidin-1-yl)phenyl]ethanone |
IUPAC Name: | 1-(3-fluoro-4-pyrrolidin-1-ylphenyl)ethanone |
Description: | 1-(3-Fluoro-4-pyrrolidin-1-ylphenyl)ethanone |
Molecular Weight: | 207.24 |
Molecular Formula: | C12H14FNO |
Canonical SMILES: | CC(=O)C1=CC(=C(C=C1)N2CCCC2)F |
InChI: | InChI=1S/C12H14FNO/c1-9(15)10-4-5-12(11(13)8-10)14-6-2-3-7-14/h4-5,8H,2-3,6-7H2,1H3 |
InChI Key: | GETWGIMLYQVKIA-UHFFFAOYSA-N |
Complexity: | 238 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 207.105942232 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 207.105942232 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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