4-amino-5-iodo-2-methoxybenzoic acid

4-amino-5-iodo-2-methoxybenzoic acid

CAS: 155928-39-5

Formula: C8H8INO3

SMILES: COC1=C(C=C(I)C(N)=C1)C(O)=O

IUPAC: 4-amino-5-iodo-2-methoxybenzoic acid

InChI: InChI=1S/C8H8INO3/c1-13-7-3-6(10)5(9)2-4(7)8(11)12/h2-3H,10H2,1H3,(H,11,12)

Composition: C (32.79%), H (2.75%), I (43.30%), N (4.78%), O (16.38%)

Molar Mass: 293.06

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	292.95489
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	XEQJZCQCBUXZJK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.84
Topological Polar Surface Area	72.55
Polarizability	21.72
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	155928-39-5		$51.35-$1,078.30$51.35$63.37$86.31$225.06$359.43$1,078.30

Chemcia Scientific, LLC

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	155928-39-5		$258.75-$1,552.50$258.75$902.75$1,552.50