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75007-32-8 | 2-(3,5-dimethyl-1h-pyrazol-1-yl)-4-methyl-1,3-thiazole
CAS No: 75007-32-8 Catalog No: AG005EZG MDL No:
Product Description
Catalog Number:
AG005EZG
Chemical Name:
2-(3,5-dimethyl-1h-pyrazol-1-yl)-4-methyl-1,3-thiazole
CAS Number:
75007-32-8
Molecular Formula:
C9H11N3S
Molecular Weight:
193.2687
IUPAC Name:
2-(3,5-dimethylpyrazol-1-yl)-4-methyl-1,3-thiazole
InChI:
InChI=1S/C9H11N3S/c1-6-4-8(3)12(11-6)9-10-7(2)5-13-9/h4-5H,1-3H3
InChI Key:
JEFRVCKLXOOWNK-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1scc(n1)C
NSC Number:
684051
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.268g/mol
Monoisotopic Mass:
193.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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