Home Nitriles 4-Methoxy-1-naphthonitrile

4-Methoxy-1-naphthonitrile

CAS No.:
5961-55-7
Catalog Number:
AG003LM4
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
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Product Description
Catalog Number:
AG003LM4
Chemical Name:
4-Methoxy-1-naphthonitrile
CAS Number:
5961-55-7
Molecular Formula:
C12H9NO
Molecular Weight:
183.2060
MDL Number:
MFCD00003925
IUPAC Name:
4-methoxynaphthalene-1-carbonitrile
InChI:
InChI=1S/C12H9NO/c1-14-12-7-6-9(8-13)10-4-2-3-5-11(10)12/h2-7H,1H3
InChI Key:
FRCZUGOIGNQOID-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)C#N
EC Number:
227-734-6
Properties
Complexity:
242  
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:
1  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties