AG0035FS

40876-98-0 | Sodium (Z)-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate

AG0035FS

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CAS Number	40876-98-0
Catalog Number	AG0035FS(AGN-PC-0RPE1P)
Chemical Name	Sodium (Z)-1,4-diethoxy-1,4-dioxo-but-2-en-2-olate
EC Number	255-122-9
IUPAC Name	sodium;(Z)-1,4-diethoxy-1,4-dioxobut-2-en-2-olate
InChI	InChI=1S/C8H12O5.Na/c1-3-12-7(10)5-6(9)8(11)13-4-2;/h5,9H,3-4H2,1-2H3;/q;+1/p-1/b6-5-;
InChI Key	UJZUICGIJODKOS-YSMBQZINSA-M
MDL Number	MFCD00035571
Molecular Formula	C8H11NaO5
Molecular Weight	210.1597
SMILES	O=C([CH-]C(OCC)=O)C(OCC)=O.[Na+]
Synonyms	40876-98-0, Diethyl oxalacetate sodium salt, Sodium 1,4-diethoxy-1,4-dioxobut-2-en-2-olate, diethyloxalacetate sodium salt, Diethyl oxosuccinate sodium salt, Sodium-1,4-diethoxy-1,4-dioxobut-2-en-2-olate, sodium (2Z)-1,4-diethoxy-1,4-dioxobut-2-en-2-olate, Ethyl sodium oxaloacetate, diethyl (2Z)-2-hydroxybut-2-ene-1,4-dioate, sodium salt, MFCD00035571, PubChem4019, AC1Q1VQA, sodium (z)-1,4-diethoxy-1,4-dioxobut-2-en-2-olate, C8H10Na2O5, SCHEMBL626010, EBD7741, UJZUICGIJODKOS-YSMBQZINSA-M, BCP11435, SBB061678, AKOS000121035, AKOS002304174, AKOS025310535, Diethyl oxalacetate sodium salt, 95%, API0002339, CS-W019382, MP-2166, BBV-60752507, SC-04345, AB0031248, RT-001619, ST2413794, O0074, ST50411060, X4262, EN300-21646, 2-(Sodiooxy)-2-butenedioic acid diethyl ester, potassium 1,4-diethoxy-1,4-dioxobut-2-en-2-olate, Diethyl oxalacetate, Sodium diethyl oxalacetate, Diethyl oxaloacetate, Diethyl sodiooxalacetate, Diethyl sodium oxalacetate, Diethyloxalacetatesodiumsalt, Sodium diethyl oxaloacetate, UNII-6CA025Y4FG, C8H11O5.Na, Sodium diethyl oxobutanedioate, 1-Ethyl-2-methyl-1H-indole, C8-H11-O5.Na, EINECS 255-122-9, Diethyl oxaloacetate, monosodium salt, Oxalacetic acid diethyl ester sodium salt, ACN-038186, Diethyl oxobutanedioate ion(1-) sodium, NSC 126906, AI3-04820, Diethyl 2-hydroxy-2-butenedioate sodium salt, Oxalacetic acid, diethyl ester, sodium deriv., Diethyl oxalacetate sodium salt, 95% - 100G 100g, Butanedioic acid, oxo-, diethyl ester, ion(1-), sodium, Butanedioic acid, 2-oxo-, 1,4-diethyl ester, ion(1-), sodium (1:1), 52980-17-3, 63277-17-8,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	210.05g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	210.161g/mol
Monoisotopic Mass	210.05g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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