Home Other Building Blocks 3-phenyl-octahydrocyclopenta[b]pyrrole

3-phenyl-octahydrocyclopenta[b]pyrrole

CAS No.:
1053170-20-9
Catalog Number:
AG01BA8R
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
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Product Description
Catalog Number:
AG01BA8R
Chemical Name:
3-phenyl-octahydrocyclopenta[b]pyrrole
CAS Number:
1053170-20-9
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD09035108
IUPAC Name:
3-phenyl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole
InChI:
InChI=1S/C13H17N/c1-2-5-10(6-3-1)12-9-14-13-8-4-7-11(12)13/h1-3,5-6,11-14H,4,7-9H2
InChI Key:
ANUWJZVDTUHQRB-UHFFFAOYSA-N
SMILES:
C1CC2C(C1)C(CN2)c1ccccc1
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties