m-Xylylenediphosphonic Acid

Catalog Number

144052-40-4

CAS

144052-40-4

IUPAC Name

[3-(phosphonomethyl)phenyl]methylphosphonic acid

Synonyms

CHEMBL147362; m-Xylylenebisphosphonic acid; SCHEMBL8040890

Molecular Weight

266.12

Molecular Formula

C8H12O6P2

MDL

MFCD22200402

Storage

Room temperature.

Signal Word

Danger

Precautionary Statement

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501

Canonical SMILES

C1=CC(=CC(=C1)CP(=O)(O)O)CP(=O)(O)O

InChI

InChI=1S/C8H12O6P2/c9-15(10,11)5-7-2-1-3-8(4-7)6-16(12,13)14/h1-4H,5-6H2,(H2,9,10,11)(H2,12,13,14)

InChI Key

PYWZCUXISXXGMI-UHFFFAOYSA-N