Home Nitriles 2-aMino-4-Methoxy-3-Methylbenzonitrile

2-aMino-4-Methoxy-3-Methylbenzonitrile

CAS No.:
923274-68-4
Catalog Number:
AG00GTZ4
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
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Product Description
Catalog Number:
AG00GTZ4
Chemical Name:
2-aMino-4-Methoxy-3-Methylbenzonitrile
CAS Number:
923274-68-4
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD03842199
IUPAC Name:
2-amino-4-methoxy-3-methylbenzonitrile
InChI:
InChI=1S/C9H10N2O/c1-6-8(12-2)4-3-7(5-10)9(6)11/h3-4H,11H2,1-2H3
InChI Key:
CDZMIQSRVJVDFS-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1C)N)C#N
Properties
Complexity:
196  
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:
1  
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties