Home Other Building Blocks 2-benzyl-2-tert-butylpyrrolidine

2-benzyl-2-tert-butylpyrrolidine

CAS No.:
1543122-66-2
Catalog Number:
AG01B6IA
Molecular Formula:
C15H23N
Molecular Weight:
217.3498
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Product Description
Catalog Number:
AG01B6IA
Chemical Name:
2-benzyl-2-tert-butylpyrrolidine
CAS Number:
1543122-66-2
Molecular Formula:
C15H23N
Molecular Weight:
217.3498
MDL Number:
MFCD21781293
IUPAC Name:
2-benzyl-2-tert-butylpyrrolidine
InChI:
InChI=1S/C15H23N/c1-14(2,3)15(10-7-11-16-15)12-13-8-5-4-6-9-13/h4-6,8-9,16H,7,10-12H2,1-3H3
InChI Key:
PPILGWOYLSTBOK-UHFFFAOYSA-N
SMILES:
CC(C1(CCCN1)Cc1ccccc1)(C)C
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.183g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.356g/mol
Monoisotopic Mass:
217.183g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties