[1-carboxy-2-(3,4-dihydroxyphenyl)ethyl]-methylazanium chloride

CAS: 51912-15-3

Molecular Formula	`C10H14ClNO4`
Molecular Weight	247.67 g/mol
Topological Polar Surface Area	94.4 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	247.06114
Heavy Atoms	16
Complexity	221.0

Chemical Identifiers

CAS Number	51912-15-3
SMILES	`C[NH2+]C(CC1=CC(=C(C=C1)O)O)C(=O)O.[Cl-]`
InChIKey	`WUBSGPKNROVQMZ-UHFFFAOYSA-N`

📖 Product Overview

[1-carboxy-2-(3,4-dihydroxyphenyl)ethyl]-methylazanium chloride (CAS: 51912-15-3) is a chemical compound with molecular formula C10H14ClNO4 and molecular weight 247.67 g/mol. Its IUPAC systematic name is [1-carboxy-2-(3,4-dihydroxyphenyl)ethyl]-methylazanium chloride. Topological Polar Surface Area 94.4 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 247.06114 Heavy Atoms 16 Complexity 221.0 InChI Key: WUBSGPKNROVQMZ-UHFFFAOYSA-N. SMILES: C[NH2+]C(CC1=CC(=C(C=C1)O)O)C(=O)O.[Cl-].

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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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