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10124-56-8 molecular structure
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hexasodium hexaoxocyclohexaphosphoxane-2,4,6,8,10,12-hexakis(olate)

ChemBase ID: 151839
Molecular Formular: Na6O18P6
Molecular Mass: 611.770386
Monoisotopic Mass: 611.68964863
SMILES and InChIs

SMILES:
[O-]P1(=O)OP(=O)([O-])OP(=O)([O-])OP(=O)(OP(=O)(OP(=O)(O1)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
Canonical SMILES:
[O-]P1(=O)OP(=O)([O-])OP(=O)([O-])OP(=O)(OP(=O)(OP(=O)(O1)[O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChI:
InChI=1S/6Na.H6O18P6/c;;;;;;1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h;;;;;;(H,1,2)(H,3,4)(H,5,6)(H,7,8)(H,9,10)(H,11,12)/q6*+1;/p-6
InChIKey:
GCLGEJMYGQKIIW-UHFFFAOYSA-H

Cite this record

CBID:151839 http://www.chembase.cn/molecule-151839.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
hexasodium hexaoxocyclohexaphosphoxane-2,4,6,8,10,12-hexakis(olate)
IUPAC Traditional name
hexasodium hexaoxocyclohexaphosphoxane-2,4,6,8,10,12-hexakis(olate)
Synonyms
Sodium metaphosphate
Sodium hexametaphosphate, tech.
Calgon
Phosphate glass, water soluble
Polyphosphate sodium salt
Sodium polyphosphate
Sodium hexametaphosphate
六偏磷酸钠, tech.
六聚偏磷酸钠
磷酸盐玻璃,水溶性
聚磷酸盐 钠盐
聚磷酸钠盐
六偏磷酸钠
CAS Number
10124-56-8
68915-31-1
EC Number
233-343-1
272-808-3
MDL Number
MFCD00136045
MFCD00134118
PubChem SID
162245985
PubChem CID
24968

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 24968 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 0.09679965  H Acceptors 12 
H Donor LogD (pH = 5.5) -16.398441 
LogD (pH = 7.4) -16.783142  Log P -2.5307908 
Molar Refractivity 58.5072 cm3 Polarizability 28.421917 Å3
Polar Surface Area 296.16 Å2 Rotatable Bonds
Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
crystalline expand Show data source
Granular expand Show data source
Melting Point
628°C expand Show data source
Boiling Point
1500°C expand Show data source
Refractive Index
1.482 expand Show data source
RTECS
OY3675000 expand Show data source
TR4950250 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
1 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter expand Show data source
Purity
96% expand Show data source
Particle Size
+200 mesh expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 305553 external link
Biochem/physiol Actions
Intended for the cytologic demonstration of Naphthol AS-D Chloroacetate Esterase in blood, bone marrow films or tissue touch preparations.
Packaging
1 kg in poly bottle
25 g in poly bottle
5 kg in poly drum

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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