1-Naphthaleneacetonitrile, 7-methoxy-


Chemical Name: 1-Naphthaleneacetonitrile, 7-methoxy-
CAS Number: 138113-08-3
Product Number: AG00180S(AGN-PC-005K78)
Synonyms:
MDL No: MFCD08704309
Molecular Formula: C13H11NO
Molecular Weight: 197.2325

Identification/Properties


Computed Properties
Molecular Weight:
197.237g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
197.084g/mol
Monoisotopic Mass:
197.084g/mol
Topological Polar Surface Area:
33A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
255
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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