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Home > Aldehydes > 2090222-34-5
2090222-34-5 | 1-methyl-3-(1,3-thiazol-2-yl)-1H-pyrazole-5-carbaldehyde
CAS No: 2090222-34-5 Catalog No: AG01BSQG MDL No:MFCD30538866
Product Description
Catalog Number:
AG01BSQG
Chemical Name:
1-methyl-3-(1,3-thiazol-2-yl)-1H-pyrazole-5-carbaldehyde
CAS Number:
2090222-34-5
Molecular Formula:
C8H7N3OS
Molecular Weight:
193.2257
MDL Number:
MFCD30538866
IUPAC Name:
2-methyl-5-(1,3-thiazol-2-yl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C8H7N3OS/c1-11-6(5-12)4-7(10-11)8-9-2-3-13-8/h2-5H,1H3
InChI Key:
DDZVLZVOQHUETQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(nn1C)c1nccs1
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.224g/mol
Monoisotopic Mass:
193.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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