(2s)-2-(Phosphonomethyl)pentanedioic Acid

Base Information

• Chemical Name: (2s)-2-(Phosphonomethyl)pentanedioic Acid
• CAS No.: 473251-81-9
• Molecular Formula: C6H11O7P
• UNII: KYW3RS2DJY
• Nikkaji Number: J1.812.679F
• Wikidata: Q27460594
• Pharos Ligand ID: ABHU1NL7DW27
• ChEMBL ID: CHEMBL189217
• Mol file: 473251-81-9.mol

Synonyms:(2s)-2-(Phosphonomethyl)pentanedioic Acid;KYW3RS2DJY;2-PMPA, (2S)-;UNII-KYW3RS2DJY;Pentanedioic acid, 2-(phosphonomethyl)-, (2S)-;(S)-2-(Phosphonomethyl)Pentanedioic Acid;473251-81-9;G88;(S)-2-PMPA;CHEMBL189217;SCHEMBL16528808;BDBM17759;Q27460594

Chemical Property of (2s)-2-(Phosphonomethyl)pentanedioic Acid

Chemical Property:

• XLogP3: -2.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 226.02423968
• Heavy Atom Count: 14
• Complexity: 267

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C(CC(=O)O)C(CP(=O)(O)O)C(=O)O
• Isomeric SMILES: C(CC(=O)O)[C@H](CP(=O)(O)O)C(=O)O

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