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1073-53-6

1073-53-6 | 4-Pyrimidinecarboxaldehyde, 6-methyl- (7CI,8CI)

CAS No: 1073-53-6 Catalog No: AG009QW9 MDL No:MFCD09881197

Product Description

Catalog Number:
AG009QW9
Chemical Name:
4-Pyrimidinecarboxaldehyde, 6-methyl- (7CI,8CI)
CAS Number:
1073-53-6
Molecular Formula:
C6H6N2O
Molecular Weight:
122.1246
MDL Number:
MFCD09881197
IUPAC Name:
6-methylpyrimidine-4-carbaldehyde
InChI:
InChI=1S/C6H6N2O/c1-5-2-6(3-9)8-4-7-5/h2-4H,1H3
InChI Key:
UVJSZAAUOFNPPG-UHFFFAOYSA-N
SMILES:
Cc1cc(C=O)ncn1

Properties

Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.048g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.127g/mol
Monoisotopic Mass:
122.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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