4,6-dibromo-1H-indole-2-carboxylic acid

4,6-dibromo-1H-indole-2-carboxylic acid

Formula: C9H5Br2NO2

SMILES: OC(=O)C1=CC2=C(Br)C=C(Br)C=C2N1

IUPAC: 4,6-dibromo-1H-indole-2-carboxylic acid

InChI: InChI=1S/C9H5Br2NO2/c10-4-1-6(11)5-3-8(9(13)14)12-7(5)2-4/h1-3,12H,(H,13,14)

Composition: C (33.89%), H (1.58%), Br (50.10%), N (4.39%), O (10.03%)

Molar Mass: 318.952

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	316.868704
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	MBJGSCSSICNDOD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.52
Topological Polar Surface Area	53.09
Polarizability	23.7
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H5Br2NO2		Quote Only