Home Nitriles Cbz-1-amino-1-cyclopropanecarbonitrile

Cbz-1-amino-1-cyclopropanecarbonitrile

CAS No.:
1159735-22-4
Catalog Number:
AG000H8U
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG000H8U
Chemical Name:
Cbz-1-amino-1-cyclopropanecarbonitrile
CAS Number:
1159735-22-4
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD16660146
IUPAC Name:
benzyl N-(1-cyanocyclopropyl)carbamate
InChI:
InChI=1S/C12H12N2O2/c13-9-12(6-7-12)14-11(15)16-8-10-4-2-1-3-5-10/h1-5H,6-8H2,(H,14,15)
InChI Key:
OKPPFSCYFICDPU-UHFFFAOYSA-N
SMILES:
N#CC1(CC1)NC(=O)OCc1ccccc1
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties