3-(4-iodophenyl)-2-(methylamino)propanoic acid

AlkaPlorer ID: AK100134

Synonym: None

IUPAC Name: 3-(4-iodophenyl)-2-(methylamino)propanoic acid

Structure

SMILES: CNC(CC1=CC=C(I)C=C1)C(=O)O

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InChI: InChI=1S/C10H12INO2/c1-12-9(10(13)14)6-7-2-4-8(11)5-3-7/h2-5,9,12H,6H2,1H3,(H,13,14)

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InChIKey: CAHSXUAIDOEVFH-UHFFFAOYSA-N

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Reference

PubChem CID: 17933024

CAS: 850161-82-9

NPASS: NPC5805

COCONUT: CNP0421391

Properties Information

Molecule Weight: 305.115

TPSA: 49.33

MolLogP: 1.5062999999999998

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information