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5-iodo-6-methyl-1H-indazole

5-iodo-6-methyl-1H-indazole

CAS: 1034154-15-8

Formula: C8H7IN2

SMILES: CC1=C(I)C=C2C=NNC2=C1

IUPAC: 5-iodo-6-methyl-1H-indazole

InChI: InChI=1S/C8H7IN2/c1-5-2-8-6(3-7(5)9)4-10-11-8/h2-4H,1H3,(H,10,11)

Composition: C (37.23%), H (2.73%), I (49.18%), N (10.86%)

Molar Mass: 258.062

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 257.96539
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey MJGCOYCORNCDRI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.48
Topological Polar Surface Area 28.68
Polarizability 21.44
Ring Count 2
Rotatable Bond Count 0

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99.91% <7 Days 1034154-15-8 $20.57-$374.94$20.57$50.49$155.21$374.94
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