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1332581-19-7 | Benzonitrile, 2-methoxy-6-(methylamino)-
CAS No: 1332581-19-7 Catalog No: AG0014GL MDL No:MFCD20268108
Product Description
Catalog Number:
AG0014GL
Chemical Name:
Benzonitrile, 2-methoxy-6-(methylamino)-
CAS Number:
1332581-19-7
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD20268108
IUPAC Name:
2-methoxy-6-(methylamino)benzonitrile
InChI:
InChI=1S/C9H10N2O/c1-11-8-4-3-5-9(12-2)7(8)6-10/h3-5,11H,1-2H3
InChI Key:
WSUNTAGFYWVNHL-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1C#N)OC
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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