Home Nitriles 2-methyl-2-(naphthalen-1-yl)propanenitrile

2-methyl-2-(naphthalen-1-yl)propanenitrile

CAS No.:
55615-31-1
Catalog Number:
AG01ALNB
Molecular Formula:
C14H13N
Molecular Weight:
195.2597
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Product Description
Catalog Number:
AG01ALNB
Chemical Name:
2-methyl-2-(naphthalen-1-yl)propanenitrile
CAS Number:
55615-31-1
Molecular Formula:
C14H13N
Molecular Weight:
195.2597
MDL Number:
MFCD11036622
IUPAC Name:
2-methyl-2-naphthalen-1-ylpropanenitrile
InChI:
InChI=1S/C14H13N/c1-14(2,10-15)13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,1-2H3
InChI Key:
PVFMNNIMYGEOAM-UHFFFAOYSA-N
SMILES:
N#CC(c1cccc2c1cccc2)(C)C
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.105g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.265g/mol
Monoisotopic Mass:
195.105g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties