Home Nitriles 2-(Pyrrolidin-1-ylmethyl)benzonitrile

2-(Pyrrolidin-1-ylmethyl)benzonitrile

CAS No.:
135277-07-5
Catalog Number:
AG009HWL
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
10g
97%
In Stock USA
United States
$525
- +
25g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG009HWL
Chemical Name:
2-(Pyrrolidin-1-ylmethyl)benzonitrile
CAS Number:
135277-07-5
Molecular Formula:
C12H14N2
Molecular Weight:
186.2530
MDL Number:
MFCD07339548
IUPAC Name:
2-(pyrrolidin-1-ylmethyl)benzonitrile
InChI:
InChI=1S/C12H14N2/c13-9-11-5-1-2-6-12(11)10-14-7-3-4-8-14/h1-2,5-6H,3-4,7-8,10H2
InChI Key:
SGOHCCLAFSXLCP-UHFFFAOYSA-N
SMILES:
N#Cc1ccccc1CN1CCCC1
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
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:
2  
Properties