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Hexametaphosphate

HCID 115276
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Basic information

CAS
13478-98-3
Standard SMILES
O=P1([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])OP(=O)([O-])O1
InChIKey
SZGVJLCXTSBVKL-UHFFFAOYSA-H
Molecular formula
O18P6-6
Average molar mass
473.83 g/mol
Monoisotopic mass
473.75103513

Names & identifiers

Preferred name
Hexametaphosphate
IUPAC
2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododecane 2,4,6,8,10,12-hexaoxide
English name
Metaphosphate (P6O186-)
Molecular formula
O18P6-6
Molecular weight
473.831766

Names & synonyms

Metaphosphate (P6O186-)Hexametaphosphate13478-98-3RefChem:146064CyclohexaphosphateSZGVJLCXTSBVKL-UHFFFAOYSA-HR2QL4SZ4JMDTXSID209287572,4,6,8,10,12-Hexaoxo-2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~,10lambda~5~,12lambda~5~-cyclohexaphosphoxane-2,4,6,8,10,12-hexakis(olate)Cyclohexaphosphoric acid2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododecane 2,4,6,8,10,12-hexaoxide2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-2$l^{5},4$l^{5},6$l^{5},8 $l^{5},10$l^{5},12$l^{5}-hexaphosphacyclododecane 2,4,6,8,10,12-hexaox ide
Show more names
2,4,6,8,10,12-hexaoxido-1,3,5,7,9,11-hexaoxa-2λ5,4λ5,6λ5,8λ5,10λ5,12λ5-hexaphosphacyclododecane 2,4,6,8,10,12-hexaoxide

Database identifiers

CAS
13478-98-3
PubChem CID
115276
DTXSID
DTXSID20928757
UNII
R2QL4SZ4JM

Properties

Computed structural propertiesFilling in

XLogP
-7.1
Topological polar surface area
296 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
18
Rotatable bonds
0
Heavy atoms
24
Formal charge
-6
Complexity
513

Physicochemical properties

EPA Substance Registry System
Metaphosphate (P6O186-) (13478-98-3)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationMetaphosphate (P6O186-): Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationMetaphosphate (P6O186-): ACTIVE

Related reactions

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Compound notes

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