3-iodo-6-methoxy-4-methyl-1H-indazole

3-iodo-6-methoxy-4-methyl-1H-indazole

CAS: 885521-45-9

Formula: C9H9IN2O

SMILES: COC1=CC(C)=C2C(I)=NNC2=C1

IUPAC: 3-iodo-6-methoxy-4-methyl-1H-indazole

InChI: InChI=1S/C9H9IN2O/c1-5-3-6(13-2)4-7-8(5)9(10)12-11-7/h3-4H,1-2H3,(H,11,12)

Composition: C (37.52%), H (3.15%), I (44.05%), N (9.72%), O (5.55%)

Molar Mass: 288.088

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	287.97596
Formal Charge	0
FSP3	0.22
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	LWNLZEJMICNYQJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.65
Topological Polar Surface Area	37.91
Polarizability	24.1
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	885521-45-9		$57.97-$323.51$57.97$109.40$323.51

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	885521-45-9		$148.80-$696.07$148.80$250.94$696.07