CAS
93841-71-5 Purity
96%
93841-71-5 Purity
96%
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Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate
CAS
93841-74-8
Catalog Number
ACM93841748
Category
Other Products
Molecular Weight
705.089505 [g/mol]
Molecular Formula
C9H22N3Na6O15P5
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Specification
Synonyms
93841-74-8, hexasodium [10,10-dihydroxy-10-oxido-2,8-bis(phosphonatomethyl)-5-(phosphonomethyl)-2,5,8-triaza-10-phosphadec-1-yl]phosphonate, Phosphonic acid, [[(phosphonomethyl)imino]bis[2,1-ethanediylnitrilobis(methylene)]]tetrakis-, hexasodium salt
IUPAC Name
hexasodium [2-[bis(phosphonatomethyl)amino]ethyl-[2-[phosphonatomethyl(phosphonomethyl)amino]ethyl]amino]methylphosphonic acid
SMILES
C(CN(CP(=O)(O)O)CP(=O)([O-])[O-])N(CCN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])CP(=O)(O)O.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChI Key
RGIYWVNNHVURLO-UHFFFAOYSA-H
EC Number
299-045-9
Exact Mass
704.91300
H-Bond Acceptor
18
H-Bond Donor
4
What is the molecular formula of Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
The molecular formula is C21H54N9Na6O81P27.
When was Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate created?
It was created on April 7, 2016.
What is the molecular weight of Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
The molecular weight is 2702.9 g/mol.
How many hydrogen bond donor counts does Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate have?
It has 24 hydrogen bond donor counts.
What is the exact mass of Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
The exact mass is 2702.2684915 g/mol.
How many rotatable bond counts are there in Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
There are 27 rotatable bond counts in the compound.
What is the topological polar surface area of Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
The topological polar surface area is 1650 Ų.
How many heavy atoms are there in Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate?
There are 144 heavy atoms in the compound.
Does Hexasodium tetrahydrogen[[(phosphonatomethyl)imino]bis[ethane-2,1-diylnitrilobis(methylene)]]tetrakisphosphonate have any defined atom stereocenter count?
No, it has 0 defined atom stereocenter count.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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