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3-methyl-4-(thiophen-2-yl)-1H-pyrazole

3-methyl-4-(thiophen-2-yl)-1H-pyrazole

CAS: 1006491-93-5

Formula: C8H8N2S

SMILES: CC1=NNC=C1C1=CC=CS1

IUPAC: 3-methyl-4-(thiophen-2-yl)-1H-pyrazole

InChI: InChI=1S/C8H8N2S/c1-6-7(5-9-10-6)8-3-2-4-11-8/h2-5H,1H3,(H,9,10)

Composition: C (58.51%), H (4.91%), N (17.06%), S (19.52%)

Molar Mass: 164.23

Atom Count: 19

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 164.04081944
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VMKBIVWGYKYTRT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.36
Topological Polar Surface Area 28.68
Polarizability 18.51
Ring Count 2
Rotatable Bond Count 1

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95% <2 Days 1006491-93-5 $51.35-$359.43$51.35$63.37$75.38$86.31$120.18$359.43
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