Home Nitriles 4-methoxy-5-methyl-1,3-thiazole-2-carbonitrile

4-methoxy-5-methyl-1,3-thiazole-2-carbonitrile

CAS No.:
2126163-05-9
Catalog Number:
AG01EJSD
Molecular Formula:
C6H6N2OS
Molecular Weight:
154.1896
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Product Description
Catalog Number:
AG01EJSD
Chemical Name:
4-methoxy-5-methyl-1,3-thiazole-2-carbonitrile
CAS Number:
2126163-05-9
Molecular Formula:
C6H6N2OS
Molecular Weight:
154.1896
MDL Number:
MFCD31381470
IUPAC Name:
4-methoxy-5-methyl-1,3-thiazole-2-carbonitrile
InChI:
InChI=1S/C6H6N2OS/c1-4-6(9-2)8-5(3-7)10-4/h1-2H3
InChI Key:
FEJXPBRDCAWPAT-UHFFFAOYSA-N
SMILES:
COc1nc(sc1C)C#N
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.02g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.187g/mol
Monoisotopic Mass:
154.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties