CAS
94230-66-7 Purity
96%
94230-66-7 Purity
96%
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Phosphonic acid,[[(3,5,5-trimethylhexyl)imino]bis(methylene)]bis-,tripotassium salt(9ci)
CAS
94230-70-3
Catalog Number
ACM94230703
Category
Other Products
Molecular Weight
445.553782
Molecular Formula
C11H27NO6P2.3K
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Specification
Synonyms
94230-70-3, Tripotassium hydrogen (((3,5,5-trimethylhexyl)imino)bis(methylene))diphosphonate, TRIPOTASSIUM HYDROGEN [[(3,5,5-TRIMETHYLHEXYL)IMINO]BIS(METHYLENE)]DIPHOSPHONATE, CTK5H5908, EINECS 303-780-3, AG-H-88508
IUPAC Name
tripotassium;hydroxy-[[phosphonatomethyl(3,5,5-trimethylhexyl)amino]methyl]phosphinate
Canonical SMILES
CC(CCN(CP(=O)(O)[O-])CP(=O)([O-])[O-])CC(C)(C)C.[K+].[K+].[K+]
InChI Key
CXTMUCJGBSQMKI-UHFFFAOYSA-K
Density
g/cm³
EC Number
303-780-3
Exact Mass
444.99900
H-Bond Acceptor
7
H-Bond Donor
1
What is the molecular formula of Phosphonic acid, [[(3,5,5-trimethylhexyl)imino]bis(methylene)]bis-, tripotassium salt(9ci)?
The molecular formula is C11H24K3NO6P2.
What is the molecular weight of Phosphonic acid, [[(3,5,5-trimethylhexyl)imino]bis(methylene)]bis-, tripotassium salt(9ci)?
The molecular weight is 445.55 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is tripotassium;hydroxy-[[phosphonatomethyl(3,5,5-trimethylhexyl)amino]methyl]phosphinate.
What is the InChIKey of the compound?
The InChIKey is CXTMUCJGBSQMKI-UHFFFAOYSA-K.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 7 hydrogen bond acceptor counts.
What is the exact mass of the compound?
The exact mass is 444.9990059 g/mol.
How many rotatable bond counts does the compound have?
The compound has 8 rotatable bond counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 127 Ų.
How many covalently-bonded unit counts does the compound have?
The compound has 4 covalently-bonded unit counts.
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