Home Nitriles (R)-1-Benzyl-3-pyrrolidinecarbonitrile

(R)-1-Benzyl-3-pyrrolidinecarbonitrile

CAS No.:
157528-56-8
Catalog Number:
AG001PHH
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>98.0%(GC)
1 week
United States
$398
- +
5g
>98.0%(GC)
1 week
United States
$1250
- +
Product Description
Catalog Number:
AG001PHH
Chemical Name:
(R)-1-Benzyl-3-pyrrolidinecarbonitrile
CAS Number:
157528-56-8
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
MDL Number:
MFCD09951967
IUPAC Name:
(3R)-1-benzylpyrrolidine-3-carbonitrile
InChI:
InChI=1S/C12H14N2/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11/h1-5,12H,6-7,9-10H2/t12-/m0/s1
InChI Key:
RYCQUUNQHVAFSM-LBPRGKRZSA-N
SMILES:
N#C[C@@H]1CCN(C1)Cc1ccccc1
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
186.116g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.258g/mol
Monoisotopic Mass:
186.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties