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Reference substances

Reference substances

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General information

Inventory

EC number:
227-833-4
EC name:
[[(2-hydroxyethyl)imino]bis(methylene)]bisphosphonic acid
CAS number:
5995-42-6

No inventory information available

Reference substance information

IUPAC name:
[[(2-hydroxyethyl)imino]bis(methylene)]bisphosphonic acid
Synonyms
Names:
Phosphonic acid, (2-hydroxyethyl)imino bis(methylene) bis-
Phosphonic acid, [[(2-hydroxyethyl)imino]bis(methylene)]bis-
Identifier:
IUPAC name
{[(2-hydroxyethyl)imino]bis(methylene)}bis(phosphonic acid)
Identifier:
other: InChl
InChI=1/C4H13NO7P2/c6-2-1-5(3-13(7,8)9)4-14(10,11)12/h6H,1-4H2,(H2,7,8,9)(H2,10,11,12)
Identifier:
other: SMILES notation
OCCN(CP(=O)(O)O)CP(=O)(O)O

CAS information

CAS number:
5995-42-6

Molecular and structural information

Molecular formula:
C4H13NO7P2
Molecular weight:
ca. 249.096
SMILES notation:
OP(=O)(O)CN(CP(=O)(O)O)CCO
InChl:
InChI=1S/C4H13NO7P2/c6-2-1-5(3-13(7,8)9)4-14(10,11)12/h6H,1-4H2,(H2,7,8,9)(H2,10,11,12)
Structural formula:
Chemical structure