AG0033F9

108-56-5 | Diethyl oxalacetate

AG0033F9

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CAS Number	108-56-5
Catalog Number	AG0033F9(AGN-PC-0JL7IB)
Chemical Name	Diethyl oxalacetate
EC Number	203-594-1
IUPAC Name	diethyl 2-oxobutanedioate
InChI	InChI=1S/C8H12O5/c1-3-12-7(10)5-6(9)8(11)13-4-2/h3-5H2,1-2H3
InChI Key	JDXYSCUOABNLIR-UHFFFAOYSA-N
MDL Number	MFCD00511083
Molecular Formula	C8H12O5
Molecular Weight	188.1779
NSC Number	68476
SMILES	C(CC(=O)C(=O)OCC)(=O)OCC
UNII	15S56468G7
Synonyms	Diethyl oxalacetate, 108-56-5, diethyl 2-oxobutanedioate, Ethyl oxalacetate, diethyl 2-oxosuccinate, Diethyl oxaloacetate, OXALACETIC ACID DIETHYL ESTER, UNII-15S56468G7, AI3-11632, Butanedioic acid, oxo-, diethyl ester, Oxalacetic acid, diethyl ester (8CI), 15S56468G7, Butanedioic acid, oxo-, diethyl ester (9CI), Oxalessigester, Oxalacetic ester, Diethyl oxosuccinate, EINECS 203-594-1, NSC 68476, diethyl2-oxosuccinate, oxalacetic diethyl ester, AC1Q5BYD, Oxalacetc acd dethyl ester, bmse000148, AC1L26IZ, ACMC-20990m, 1,4-diethyl 2-oxobutanedioate, SCHEMBL1680531, CTK4A6093, DTXSID60148351, JDXYSCUOABNLIR-UHFFFAOYSA-N, 2-oxobutanedioic acid diethyl ester, NSC68476, ZINC5573987, ANW-15956, NSC-68476, AKOS009130405, AJ-54328, AK-46669, AN-42890, BR-46669, CJ-12659, SC-49649, AB0088654, AX8010710, DB-012777, TR-033085, Butanedioic acid,2-oxo-, 1,4-diethyl ester, FT-0631606, O0073, S-1463, I14-7438, J-523845, Aminochlorthenoxycycline, Oxalacetic acid, diethyl ester, Butanedioic acid, diethyl ester, C8H12O5, CID66951, AR-1I4466, C8-H12-O5, 2-Oxobutanedioic acid 1,4-diethyl ester, Oxalacetic acid diethyl ester sodium salt, 63277-17-8, 110-32-7,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.068g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.179g/mol
Monoisotopic Mass	188.068g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	69.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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