3-carboxy-O-methyltyrosine

5-(2-amino-2-carboxyethyl)-2-methoxybenzoic acid

CAS: 3641-50-7

Molecular Formula	`C11H13NO5`
Molecular Weight	239.22 g/mol
LogP	-1.9
Topological Polar Surface Area	110.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	239.07938
Heavy Atoms	17
Complexity	294.0

Chemical Identifiers

CAS Number	3641-50-7
SMILES	`COC1=C(C=C(C=C1)CC(C(=O)O)N)C(=O)O`
InChIKey	`DXJCCIMDJQJHPX-UHFFFAOYSA-N`

📖 Product Overview

3-carboxy-O-methyltyrosine (CAS: 3641-50-7) is a chemical compound with molecular formula C11H13NO5 and molecular weight 239.22 g/mol. Its IUPAC systematic name is 5-(2-amino-2-carboxyethyl)-2-methoxybenzoic acid. LogP -1.9 Topological Polar Surface Area 110.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 239.07938 Heavy Atoms 17 Complexity 294.0 InChI Key: DXJCCIMDJQJHPX-UHFFFAOYSA-N. SMILES: COC1=C(C=C(C=C1)CC(C(=O)O)N)C(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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