Home Other Building Blocks 3-(3,5-dimethoxyphenyl)pyrrolidine

3-(3,5-dimethoxyphenyl)pyrrolidine

CAS No.:
129084-50-0
Catalog Number:
AG019YO4
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
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Product Description
Catalog Number:
AG019YO4
Chemical Name:
3-(3,5-dimethoxyphenyl)pyrrolidine
CAS Number:
129084-50-0
Molecular Formula:
C12H17NO2
Molecular Weight:
207.2689
MDL Number:
MFCD14706466
IUPAC Name:
3-(3,5-dimethoxyphenyl)pyrrolidine
InChI:
InChI=1S/C12H17NO2/c1-14-11-5-10(6-12(7-11)15-2)9-3-4-13-8-9/h5-7,9,13H,3-4,8H2,1-2H3
InChI Key:
HAJKRJTVGSUQQF-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)OC)C1CNCC1
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.126g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
207.273g/mol
Monoisotopic Mass:
207.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties