CAS
5333-42-6 Purity
97%
5333-42-6 Purity
97%
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Specification
The molecular formula is C6H8NO3P.
The molecular weight is 173.11 g/mol.
The IUPAC name is (4-aminophenyl)phosphonic acid.
The InChI is InChI=1S/C6H8NO3P/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10).
The InChIKey is OAOBMEMWHJWPNA-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=CC=C1N)P(=O)(O)O.
The CAS number is 5337-17-7.
The EC number is 226-260-7.
The UNII is 5WCV1BQ6M2.
Yes, it is a canonicalized compound.