AG0034QE

609-09-6 | Diethyl 2-oxomalonate

AG0034QE

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CAS Number	609-09-6
Catalog Number	AG0034QE(AGN-PC-0JL8T4)
Chemical Name	Diethyl 2-oxomalonate
EC Number	210-176-2
IUPAC Name	diethyl 2-oxopropanedioate
InChI	InChI=1S/C7H10O5/c1-3-11-6(9)5(8)7(10)12-4-2/h3-4H2,1-2H3
InChI Key	DBKKFIIYQGGHJO-UHFFFAOYSA-N
MDL Number	MFCD28101749
Molecular Formula	C7H10O5
Molecular Weight	174.1513
NSC Number	53478
SMILES	O=C(C(=O)OCC)C(=O)OCC
UNII	H28C8N13IK
Synonyms	diethyl mesoxalate, diethyl mesoxalate hydrate, Diethyl ketomalonate, 609-09-6, Diethyl mesoxalate, Diethyl 2-oxomalonate, Diethyl oxomalonate, Ethyl mesoxalate, Ethyl ketomalonate, Propanedioic acid, oxo-, diethyl ester, diethylketomalonate, diethyl 2-oxopropanedioate, Mesoxalic acid, diethyl ester, UNII-H28C8N13IK, Mesoxalic Acid Diethyl Ester, Diethyl ketomalonate, 95%, H28C8N13IK, 1,3-diethyl 2-oxopropanedioate, DBKKFIIYQGGHJO-UHFFFAOYSA-N, MFCD00009121, AK-49975, Propanedioic acid, 2-oxo-, 1,3-diethyl ester, Diethyl oxopropanedioate, Oxopropanedioic acid diethyl ester, Di-ethylketomalonate, EINECS 210-176-2, NSC 53478, diethyl-2-oxomalonate, diethyl 2-ketomalonate, diethyl 2-keto-malonate, AI3-08189, Diethyl 2-oxomalonate #, 2-Oxomalonic acid diethyl, ACMC-209mn3, AC1L2B4M, Ketomalonic acid diethyl ester, SCHEMBL247694, AC1Q63O5, DTXSID5060566, CTK3J3262, DBKKFIIYQGGHJO-UHFFFAOYSA-, 2-oxo-malonic acid diethyl ester, diethyl 2-oxo-1,3-propanedioate, Diethyl 2-oxopropane-1,3-dioate, Oxopropanedioic acid, diethyl ester, NSC53478, ZINC1684559, ZX-AT006832, ANW-33613, KM0447, NSC-53478, OR6568, 2-oxo-propanedioic acid diethyl ester, Mesoxalic acid, diethyl ester (8CI), AKOS005207254, AB00962, RTR-032695, TRA0024059, KS-000001V0, AJ-29798, AN-46413, AS-18445, BC651577, BP-10704, BR-49975, CC-26698, CJ-27791, SC-16620, SY005090, AX8003829, DB-053736, ST2419237, TR-032695, FT-0624793, M0866, W7328, MFCD00009121 (95%), C-05810, M111014, S14-0710, F0001-1596, InChI=1/C7H10O5/c1-3-11-6(9)5(8)7(10)12-4-2/h3-4H2,1-2H3, ethyl oxomalonate, Propanedioic acid, diethyl ester, C7H10O5, CID69105, AR-1I9770, C7-H10-O5, C3003, 6265-33-4,

Complexity	176
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.152g/mol
Monoisotopic Mass	174.053g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	69.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number