AK398595

Synopsis, Chemistry

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Also known as: 154804-51-0, Disodium;1,3-dihydroxypropan-2-yl phosphate;hydrate, 819-83-0, Sodium 1,3-dihydroxypropan-2-yl phosphate hydrate(2:1:x), Sodium 1,3-dihydroxypropan-2-yl phosphate hydrate, Glycerol phosphate disodium salt hydrate, isomeric mixture

Molecular Formula

C₃H₉Na₂O₇P

Molecular Weight

234.05 g/mol

InChI Key

ROPZSVKNEIIIDE-UHFFFAOYSA-L

1 2D Structure

AK398595

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

disodium;1,3-dihydroxypropan-2-yl phosphate;hydrate

2.1.2 InChI

InChI=1S/C3H9O6P.2Na.H2O/c4-1-3(2-5)9-10(6,7)8;;;/h3-5H,1-2H2,(H2,6,7,8);;;1H2/q;2*+1;/p-2

2.1.3 InChI Key

ROPZSVKNEIIIDE-UHFFFAOYSA-L

2.1.4 Canonical SMILES

C(C(CO)OP(=O)([O-])[O-])O.O.[Na+].[Na+]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 154804-51-0

2. Disodium;1,3-dihydroxypropan-2-yl Phosphate;hydrate

3. 819-83-0

4. Sodium 1,3-dihydroxypropan-2-yl Phosphate Hydrate(2:1:x)

5. Sodium 1,3-dihydroxypropan-2-yl Phosphate Hydrate

6. Glycerol Phosphate Disodium Salt Hydrate, Isomeric Mixture

7. B-glycerophosphate Disodium Salt Hydrate

8. Glycerol 2-phosphate Disodium Salt Hydrate

9. Sodium Glycerophosphate (usan)

10. Akos025311014

11. Ss-glycerophosphate Disodium Salt Hydrate

12. D10489

13. Beta-glycerophosphate Disodium Salt Hydrate, <=1.0 Mol % L-alpha-isomer

14. Beta-glycerophosphate Disodium Salt Hydrate, Powder, Bioreagent, Suitable For Cell Culture

15. 305808-17-7

16. Beta-glycerophosphate Disodium Salt Hydrate, <=2.4 Mol % Alpha-isomer((based On C3h7o6pna2 With X H2o))

17. Beta-glycerophosphate Disodium Salt Hydrate, Bioultra, Suitable For Cell Culture, Suitable For Plant Cell Culture, >=99.0% (titration)

2.3 Create Date

2007-07-16

3 Chemical and Physical Properties

Molecular Formula	C₃H₉Na₂O₇P
Molecular Weight	234.05 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	233.98812818 g/mol
Monoisotopic Mass	233.98812818 g/mol
Topological Polar Surface Area	114 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	113
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	4