AG00397M

58986-28-0 | Sodium 3-Ethoxy-3-Oxo-1-Propen-1-Olate

AG00397M

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CAS Number	58986-28-0
Catalog Number	AG00397M(AGN-PC-04723S)
Chemical Name	Sodium 3-Ethoxy-3-Oxo-1-Propen-1-Olate
EC Number	261-544-4
IUPAC Name	sodium;(E)-3-ethoxy-3-oxoprop-1-en-1-olate
InChI	InChI=1S/C5H8O3.Na/c1-2-8-5(7)3-4-6;/h3-4,6H,2H2,1H3;/q;+1/p-1/b4-3+;
InChI Key	ITWVTNYFGKFDGE-BJILWQEISA-M
MDL Number	MFCD00234954
Molecular Formula	C5H7NaO3
Molecular Weight	138.0970
SMILES	[Na+].O=C[CH-]C(=O)OCC
Synonyms	Sodium 3-ethoxy-3-oxoprop-1-en-1-olate, 58986-28-0, 3-ethoxy-3-oxoprop-1-en-1-olate sodium salt, 863581-67-3, Sodium 3-Ethoxy-3-Oxo-1-Propen-1-Olate, SCHEMBL1396130, 8763AB, MFCD00234954, 3-(Sodiooxy)acrylic acid ethyl ester, AKOS016008941, SB21869, SC-71247, ETHYL HYDROXYMETHYLENEACETATE, SODIUM SALT, 287390-25-4, sodiumethyl3-oxidoacrylate, C5H7NaO3, Sodium ethyl 3-oxidoacrylate, C5-H8-O3.Na, EINECS 261-544-4, Sodium (E)-2-ethoxycarbonylethenolate, CID11217289,

Complexity	100
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	138.029g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	138.098g/mol
Monoisotopic Mass	138.029g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number