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819-83-0

Basic Information
CAS No.: 819-83-0
Name: Disodium beta-glycerophosphate pentahydrate
Article Data: 3
Molecular Structure:
Molecular Structure of 819-83-0 (Disodium beta-glycerophosphate pentahydrate)
Formula: C3H9 O6 P . 2 Na
Molecular Weight: 216.038
Synonyms: 1,2,3-Propanetriol,2-(dihydrogen phosphate), disodium salt (9CI); Glycerol, 2-(dihydrogen phosphate),disodium salt (8CI); Disodium glycerol 2-phosphate; Disodium glycerophosphate;Disodium b-glycerophosphate; Sodiumglycerophosphate (Na2O6PC3H7); Sodium b-glycerol phosphate; Sodium b-glycerophosphate; b-Glycerophosphate disodium; b-Phosphoglycerol sodium
EINECS: 212-464-3
Melting Point: 102-104 °C(lit.)
Boiling Point: 485.5 °C at 760 mmHg
Flash Point: 247.4 °C
Solubility: freely soluble in water
Appearance: White to cream crystalline powder
Hazard Symbols:
Risk Codes: R36/37/38   
Safety: 26-37/39
PSA: 159.61000
LogP: -0.93190
Synthetic route
Conditions
ConditionsYield
Stage #1: glycerol With sodium dihydrogenphosphate at 120 - 125℃; for 120h;
Stage #2: With sodium hydroxide at 100 - 105℃; for 20h; Temperature;
A 48%
B n/a
With sodium pyrophosphate; alkaline phosphatase In water at 40℃; for 48h; Product distribution; Rate constant; Effect of pH, acceptor concentration, chain length of the phosphoryl donor, origin and purity of the phosphatases, cosolvents (glymes);
With sodium pyrophosphate; calf intestine; alkaline phosphatase In water at 40℃; for 48h; Yield given. Yields of byproduct given;

1,3-bis(pivaloyl)glycerol phosphate

819-83-0

Sodium beta-glycerophosphate

Conditions
ConditionsYield
With sodium hydroxide; water at 65℃; pH=12 - 13;
2466-76-4

N-Acetylimidazole

819-83-0

Sodium beta-glycerophosphate

bis(acetyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water-d2; formamide at 20℃; for 72h; pH=7.4; Solvent;100%
17450-31-6

N-octanoyl imidazole

819-83-0

Sodium beta-glycerophosphate

bis(octanoyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water-d2; formamide at 20℃; for 24h; pH=7.4; Solvent;100%
2466-76-4

N-Acetylimidazole

819-83-0

Sodium beta-glycerophosphate

A

C5H11O7P

B

bis(acetyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water; water-d2; formamide at 20℃; for 12h; pH=7.4; Solvent;A 22%
B 77%
In water; water-d2 at 20℃; for 3h; pH=7.4; Solvent;A 51%
B 31%
819-83-0

Sodium beta-glycerophosphate

4122-54-7

1-Imidazol-1-yl-butan-1-one

A

C7H15O7P

B

bis(butanoyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water; water-d2 at 20℃; for 12h; pH=7.4; Solvent;A 27%
B 70%
In water; water-d2 at 20℃; for 23h; pH=7.4; Solvent;A 49%
B 27%
69205-88-5

N-decanoyl imidazole

819-83-0

Sodium beta-glycerophosphate

A

monodecanoylglycerol-2-phosphate

B

bis(decanoyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water; water-d2; formamide at 20℃; for 72h; pH=7.4; Solvent;A 70%
B 8%
819-83-0

Sodium beta-glycerophosphate

102342-65-4

N-nonanoylimidazole

A

monononanoylglycerol-2-phosphate

B

bis(nonanoyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water; water-d2; formamide at 20℃; for 48h; pH=7.4; Solvent;A 28%
B 68%
In water; water-d2; acetonitrile at 20℃; for 96h; pH=7.4; Solvent;A 39%
B 32%
60988-34-3

1-(1-imidazolyl)-1-hexanone

819-83-0

Sodium beta-glycerophosphate

A

C9H19O7P

B

bis(hexanoyl)glycerol-2-phosphate

Conditions
ConditionsYield
In water; water-d2; formamide at 20℃; for 12h; pH=7.4; Solvent;A 31%
B 65%
In water; water-d2 at 20℃; for 15h; pH=7.4; Solvent;A 49%
B 11%

(Cu2(μ-O-OAc)2(1,4,7,10,13,16-hexaazacyclooctadecane))(PF6)2

819-83-0

Sodium beta-glycerophosphate

625108-94-3

[Cu2(1,4,7,10,13,16-hexaazacylooctadecane)(μ-O-OPO3CH(CH2OH)2)2]

Conditions
ConditionsYield
In water addn. of Na2(PO6C3H7) to soln. of Cu2(NHCH2CH2)6(OAc)2 with vigorous stirring; evapn. in air for a week; crystn.; elem. anal.;60%
Raw Materials
56-81-5
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Chemistry

The Molecular Structure of 1,2,3-Propanetriol, 2-(dihydrogen phosphate), sodium salt (1:2) (CAS NO.819-83-0):

Empirical Formula: C3H7Na2O6P
Molecular Weight: 216.0374
IUPAC: disodium 2,3-dihydroxypropyl phosphate
Appearance: white crystalline powder
Nominal Mass: 216 Da
Average Mass: 216.0374 Da
Monoisotopic Mass: 215.977564 Da 
Flash Point: 249.1 °C
Enthalpy of Vaporization: 86.9 kJ/mol
Boiling Point: 488.2 °C at 760 mmHg 
Melting Point: 102-104 °C(lit.)
Storage temp: Store at RT
Water Solubility: freely soluble
Vapour Pressure: 1.4E-11 mmHg at 25°C 
InChI
InChI=1/C5H13O6P.C3H9O6P.4Na/c6-3-1-5(2-4-7)11-12(8,9)10;4-1-3(5)2-9-10(6,7)8;;;;/h5-7H,1-4H2,(H2,8,9,10);3-5H,1-2H2,(H2,6,7,8);;;;/q;;4*+1/p-4
Smiles
O(C(CCO)CCO)P([O-])([O-])=O.O(P(=O)([O-])[O-])C[C@@H](CO)O.[Na+].[Na+].[Na+].[Na+]

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 3400mg/kg (3400mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2502735,

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38: Irritating to eyes, respiratory system and skin
Safety Statements: 26-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S37/39: Wear suitable gloves and eye/face protection
WGK Germany: 3
RTECS: UA0600000

Specification

 1,2,3-Propanetriol, 2-(dihydrogen phosphate), sodium salt (1:2) (CAS NO.819-83-0) is also called as Disodium glycerol 2-phosphate ; Disodium glycerophosphate ; EINECS 212-464-3 ; Glycerol, 2-(dihydrogen phosphate), disodium salt ; Sodium beta-glycerol phosphate ; Sodium beta-glycerophosphate ; Sodium glycerophosphosphate ; UNII-YP1H63LJ2K ; beta-Natrium glycerophosphat ; beta-Natrium glycerophosphat [German] ; 1,2,3-Propanetriol, 2-(dihydrogen phosphate), disodium salt ; Disodium beta-glycerophosphate .