Home Other Building Blocks 3-(3-fluoro-4-methoxyphenyl)-2-methylpyrrolidine

3-(3-fluoro-4-methoxyphenyl)-2-methylpyrrolidine

CAS No.:
1530789-95-7
Catalog Number:
AG01EJ6Q
Molecular Formula:
C12H16FNO
Molecular Weight:
209.2599
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Product Description
Catalog Number:
AG01EJ6Q
Chemical Name:
3-(3-fluoro-4-methoxyphenyl)-2-methylpyrrolidine
CAS Number:
1530789-95-7
Molecular Formula:
C12H16FNO
Molecular Weight:
209.2599
MDL Number:
MFCD21162164
IUPAC Name:
3-(3-fluoro-4-methoxyphenyl)-2-methylpyrrolidine
InChI:
InChI=1S/C12H16FNO/c1-8-10(5-6-14-8)9-3-4-12(15-2)11(13)7-9/h3-4,7-8,10,14H,5-6H2,1-2H3
InChI Key:
HQBDEDMVVPGGDX-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)C1CCNC1C
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.122g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.264g/mol
Monoisotopic Mass:
209.122g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties