Home Nitriles 3-(2,3-dihydro-1H-indol-1-yl)propanenitrile

3-(2,3-dihydro-1H-indol-1-yl)propanenitrile

CAS No.:
91349-96-1
Catalog Number:
AG019LB9
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
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Product Description
Catalog Number:
AG019LB9
Chemical Name:
3-(2,3-dihydro-1H-indol-1-yl)propanenitrile
CAS Number:
91349-96-1
Molecular Formula:
C11H12N2
Molecular Weight:
172.2264
MDL Number:
MFCD09863394
IUPAC Name:
3-(2,3-dihydroindol-1-yl)propanenitrile
InChI:
InChI=1S/C11H12N2/c12-7-3-8-13-9-6-10-4-1-2-5-11(10)13/h1-2,4-5H,3,6,8-9H2
InChI Key:
TUVNVZQRVAQHKU-UHFFFAOYSA-N
SMILES:
N#CCCN1CCc2c1cccc2
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties