Home Nitriles 1-Hydroxynaphthalene-2-carbonitrile

1-Hydroxynaphthalene-2-carbonitrile

CAS No.:
67176-26-5
Catalog Number:
AG00FEGD
Molecular Formula:
C11H7NO
Molecular Weight:
169.1794
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Product Description
Catalog Number:
AG00FEGD
Chemical Name:
1-Hydroxynaphthalene-2-carbonitrile
CAS Number:
67176-26-5
Molecular Formula:
C11H7NO
Molecular Weight:
169.1794
MDL Number:
MFCD17012369
IUPAC Name:
1-hydroxynaphthalene-2-carbonitrile
InChI:
InChI=1S/C11H7NO/c12-7-9-6-5-8-3-1-2-4-10(8)11(9)13/h1-6,13H
InChI Key:
QKXUIBZLBWCUNU-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1O)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:
169.053g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.183g/mol
Monoisotopic Mass:
169.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties