2-Deoxyribose 5-phosphate sodium salt - CAS 102916-66-5

Catalog:	BB000967
Product Name:	2-Deoxyribose 5-phosphate sodium salt
CAS:	102916-66-5
Synonyms:	(2,3-dihydroxy-5-oxopentyl) dihydrogen phosphate;sodium

Technical Data

IUPAC Name:	sodium;[(2R,3S)-2,3-dihydroxy-5-oxopentyl] hydrogen phosphate
Description:	2-Deoxyribose 5-phosphate sodium salt (CAS# 102916-66-5) is used in the chemoenzymatic preparation of deoxyribonucleosides as starting materials in the enzymic preparation of natural and modified purine and pyrimidine nucleosides. It is used in the synthesis of 2-Oxo-3-deoxy-6-phosphogluconate (ODPG) aldolase which is useful as a catalyst in organic synthesis.
Molecular Weight:	214.11 (free acid)
Molecular Formula:	C5H11O7P · xNa+
Canonical SMILES:	C(C=O)C(C(COP(=O)(O)O)O)O.[Na]
InChI:	InChI=1S/C5H11O7P.Na/c6-2-1-4(7)5(8)3-12-13(9,10)11;/h2,4-5,7-8H,1,3H2,(H2,9,10,11);
InChI Key:	ZRNGXBHWCWMPOF-UHFFFAOYSA-N
MDL:	MFCD00057568
LogP:	-0.71710

Complexity:	210
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	236.00618393
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	236.00618393
Rotatable Bond Count:	6
Topological Polar Surface Area:	127
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0