BRN 2913394

2-phenyl-2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]acetic acid

CAS: 23189-36-8

Molecular Formula	`C18H16I3NO4`
Molecular Weight	691.0 g/mol
LogP	5.0
Topological Polar Surface Area	66.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	690.8214
Heavy Atoms	26
Complexity	501.0

Chemical Identifiers

CAS Number	23189-36-8
SMILES	`CCC(=O)N(C)C1=C(C(=C(C=C1I)I)OC(C2=CC=CC=C2)C(=O)O)I`
InChIKey	`RNFAMUAINAMCMY-UHFFFAOYSA-N`

📖 Product Overview

BRN 2913394 (CAS: 23189-36-8) is a chemical compound with molecular formula C18H16I3NO4 and molecular weight 691.0 g/mol. Its IUPAC systematic name is 2-phenyl-2-[2,4,6-triiodo-3-[methyl(propanoyl)amino]phenoxy]acetic acid. LogP 5.0 Topological Polar Surface Area 66.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 690.8214 Heavy Atoms 26 Complexity 501.0 InChI Key: RNFAMUAINAMCMY-UHFFFAOYSA-N. SMILES: CCC(=O)N(C)C1=C(C(=C(C=C1I)I)OC(C2=CC=CC=C2)C(=O)O)I.

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