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1269291-71-5 | Thiazole, 2-[1-(1,1-dimethylethyl)-1H-pyrazol-5-yl]-
CAS No: 1269291-71-5 Catalog No: AG000TJ3 MDL No:MFCD20275433
Product Description
Catalog Number:
AG000TJ3
Chemical Name:
Thiazole, 2-[1-(1,1-dimethylethyl)-1H-pyrazol-5-yl]-
CAS Number:
1269291-71-5
Molecular Formula:
C10H13N3S
Molecular Weight:
207.2953
MDL Number:
MFCD20275433
IUPAC Name:
2-(2-tert-butylpyrazol-3-yl)-1,3-thiazole
InChI:
InChI=1S/C10H13N3S/c1-10(2,3)13-8(4-5-12-13)9-11-6-7-14-9/h4-7H,1-3H3
InChI Key:
TVDHWTGZBHIPER-UHFFFAOYSA-N
SMILES:
CC(n1nccc1c1nccs1)(C)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.083g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.295g/mol
Monoisotopic Mass:
207.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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