AG0035IX

80370-42-9 | Ethyl 2-formyl-3-oxopropanoate

AG0035IX

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CAS Number	80370-42-9
Catalog Number	AG0035IX(AGN-PC-0NEPV4)
Chemical Name	Ethyl 2-formyl-3-oxopropanoate
IUPAC Name	ethyl 2-formyl-3-oxopropanoate
InChI	InChI=1S/C6H8O4/c1-2-10-6(9)5(3-7)4-8/h3-5H,2H2,1H3
InChI Key	HMFLBGNCDZYITR-UHFFFAOYSA-N
MDL Number	MFCD11112084
Molecular Formula	C6H8O4
Molecular Weight	144.1253
SMILES	C(=O)C(C(=O)OCC)C=O
Synonyms	80370-42-9, ethyl 2-formyl-3-oxopropanoate, Ethyl 2-formyl 3-oxopropanoate, Ethyl-2-formyl-3-oxopropionate, 2-FORMYL-3-OXO-PROPANOIC ACID ETHYL ESTER, Ethyl 2-formyl-3-oxopropionate, ethoxycarbonylmalonaldehyde, Propanoic acid, 2-formyl-3-oxo-, ethyl ester, Propanoicacid,2-formyl-3-oxo-,ethylester, 2-FORMYL-3-OXOPROPIONIC ACID ETHYL ESTER, 2-Formyl-3-oxopropanoic Acid Ethyl Ester, 2-formyl-3-oxo-propionic acid ethyl ester, Ethyl 2-formyl-3-oxo-propanoate, Ethyl Diformylacetate, carbethoxymalonaldehyde, ACMC-20knr3, ethyl 2,2-diformylacetate, SCHEMBL241537, Diformylacetic Acid Ethyl Ester, CTK5E7723, DTXSID80452447, HMFLBGNCDZYITR-UHFFFAOYSA-N, BCP10961, 2527AC, CE-573, MFCD11112084, ZINC39642481, AKOS005137890, PB13383, RL05093, Formyl-3-oxo-propionic acid ethyl ester, AK-40239, AN-36487, AS-10161, BC684655, CJ-20004, SC-43793, AB0055754, AJ-100477, propanoic acid,2-formyl-3-oxo-,ethyl ester, 4CH-008067, E1128, FT-0648814, ST24030519, Propanoic acid,2-formyl-3-oxo-, ethyl ester, Q-1052, 370E429, J-509534, I14-16461, C6H8O4, ACN-051386, CID11029955, C3217,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.042g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	144.126g/mol
Monoisotopic Mass	144.042g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	60.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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