Home Nitriles Acetonitrile,2-(2-naphthalenyloxy)-

Acetonitrile,2-(2-naphthalenyloxy)-

CAS No.:
104097-35-0
Catalog Number:
AG007ERB
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
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Product Description
Catalog Number:
AG007ERB
Chemical Name:
Acetonitrile,2-(2-naphthalenyloxy)-
CAS Number:
104097-35-0
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD00245496
IUPAC Name:
2-naphthalen-2-yloxyacetonitrile
InChI:
InChI=1S/C12H9NO/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,8H2
InChI Key:
YVRXIVWRURPCRV-UHFFFAOYSA-N
SMILES:
N#CCOc1ccc2c(c1)cccc2
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.068g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.21g/mol
Monoisotopic Mass:
183.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties