AG00IKFO

6381-77-7 | D-erythro-Hex-2-enonic acid, g-lactone, monosodium salt

AG00IKFO

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CAS Number	6381-77-7
Catalog Number	AG00IKFO(AGN-PC-0TA3MP)
Chemical Name	D-erythro-Hex-2-enonic acid, g-lactone, monosodium salt
EC Number	228-973-9
IUPAC Name	sodium;(2R)-2-[(1R)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-olate
InChI	InChI=1S/C6H8O6.Na/c7-1-2(8)5-3(9)4(10)6(11)12-5;/h2,5,7-10H,1H2;/q;+1/p-1/t2-,5-;/m1./s1
InChI Key	PPASLZSBLFJQEF-RKJRWTFHSA-M
MDL Number	MFCD00067298
Molecular Formula	C6H7NaO6
Molecular Weight	198.1060
SMILES	O=C1C(O)=C(O)[C@@]([H])([C@@H](CO[Na])O)O1
UNII	BZ468R6XRD
Synonyms	D-araboascorbic acid, erythorbic acid, erythroascorbic acid, isoascorbic acid, isoascorbic acid, disodium salt, isoascorbic acid, monosodium salt, isoascorbic acid, sodium salt, sodium erythorbate, SODIUM ERYTHORBATE, Sodium isoascorbate, Isona, Neo-cebitate, Mercate 20, Isoascorbic acid sodium salt, 6381-77-7, D-Isoascorbate, UNII-BZ468R6XRD, CCRIS 2517, HSDB 741, EINECS 228-973-9, Sodium erythorbate (1:1), Erythorbic Acid Sodium Salt, BZ468R6XRD, Araboascorbic acid, monosodium salt, D-, Monosodium D-erythro-hex-2-enonic acid gamma-lactone, 2,3-Didehydro-3-O-sodio-D-erythro-hexono-1,4-lactone, D-Erythro-hex-2-enonic acid, gamma-lactone, monosodium salt, E316, Hex-2-enonic acid gamma-lactone, D-erythro-, monosodium salt, Erythorbate, sodium, Erythorbic acid, sodium salt, D-Sodiumisoascorbiate, C6H8O6.Na, Eribate N, Erbit N, Sodium D-isoascorbate, Sodium D-Araboascorbate, sodium (2R)-2-[(2R)-3,4-dihydroxy-5-oxo-2,5-dihydrofuran-2-yl]-2-hydroxyethanolate, DSSTox_CID_570, EC 228-973-9, DSSTox_RID_75664, DSSTox_GSID_20570, CHEMBL2309028, DTXSID5020570, isoascorbic acid, monosodium salt, D-Araboascorbic Acid Sodium Salt, Araboascorbic acid monosodium salt, PPASLZSBLFJQEF-RKJRWTFHSA-M, Tox21_300159, LS-1538, NCGC00254156-01, AN-19024, CAS-6381-77-7, I0232, D-erythro-Hex-2-enonic acid gamma-lactone monosodium salt, D-erythro-Hex-2-enonic acid, gamma-lactone, sodium salt (1:1), sodium (2R)-2-[(1R)-1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-olate, Sodium Erythorbic, C6-H8-O6.Na, D-Araboascorbic acid, monosodium salt, Sodium erythorbate (sodium D-isoascorbate), D-erythro-Hex-2-enonic acid, ?-lactone, monosodium salt, D-erythro-Hex-2-enonic acid, .gamma.-lactone, monosodium salt, 2, 3- didehydro- 3- O- sodio- D- erythro- hexono- 1, 4- lactone,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	198.014g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	198.106g/mol
Monoisotopic Mass	198.014g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	110A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H320
Packing Group
Precautionary statements	P264-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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