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1249535-11-2 | 1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazole-4-carbaldehyde
CAS No: 1249535-11-2 Catalog No: AG01AGAY MDL No:MFCD16109124
Product Description
Catalog Number:
AG01AGAY
Chemical Name:
1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-pyrazole-4-carbaldehyde
CAS Number:
1249535-11-2
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
MDL Number:
MFCD16109124
IUPAC Name:
1-methyl-3-(1-methylpyrazol-4-yl)pyrazole-4-carbaldehyde
InChI:
InChI=1S/C9H10N4O/c1-12-4-7(3-10-12)9-8(6-14)5-13(2)11-9/h3-6H,1-2H3
InChI Key:
KSHGWOUWVYASPS-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1cnn(c1)C)C
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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