AG001FRC

141-97-9 | Butanoic acid, 3-oxo-, ethyl ester

AG001FRC

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CAS Number	141-97-9
Catalog Number	AG001FRC(AGN-PC-009QAJ)
Chemical Name	Butanoic acid, 3-oxo-, ethyl ester
EC Number	205-516-1
FEMA Number	2415
IUPAC Name	ethyl 3-oxobutanoate
InChI	InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3
InChI Key	XYIBRDXRRQCHLP-UHFFFAOYSA-N
MDL Number	MFCD00009199
Molecular Formula	C6H10O3
Molecular Weight	130.1418
NSC Number	8657
RTECS Number	AK5250000
SMILES	O=C(OCC)CC(=O)C
UN Number	1993
UNII	IZP61H3TB1
Synonyms	ethyl 3-oxobutanoate, ethyl acetoacetate, ethyl acetoacetate, 1,2-(14)C-labeled, ethyl acetoacetate, 1,3-(14)C-labeled, ethyl acetoacetate, 14C4-labeled, ethyl acetoacetate, 2,4-(14)C-labeled, ethyl acetoacetate, 2-(14)C-labeled, ethyl acetoacetate, 3-(14)C-labeled, ethyl acetoacetate, ethyl 3-oxobutanoate, 141-97-9, ethyl acetylacetate, diacetic ether, ethyl 3-oxobutyrate, Butanoic acid, 3-oxo-, ethyl ester, ethyl acetylacetonate, acetoacetic acid, ethyl ester, Acetoacetic ester, 3-oxobutanoic acid ethyl ester, Active acetylacetate, Ethyl acetyl acetate, active acetyl acetate, ACETOACETIC ACID ETHYL ESTER, 3-Oxo-butyric acid ethyl ester, ethyl beta-ketobutyrate, Ethylacetacetat, ethyl-acetoacetate, Acetoctan ethylnaty, 1-Ethoxybutane-1,3-dione, 3-Oxobutyric Acid Ethyl Ester, Ethylacetacetat [Czech], UNII-IZP61H3TB1, NSC 8657, Acetoctan ethylnaty [Czech], Ethylester kyseliny acetoctove, ethyl-3-oxobutanoate, FEMA No. 2415, CCRIS 1343, HSDB 402, EAA, EINECS 205-516-1, MFCD00009199, Ethylester kyseliny acetoctove [Czech], IZP61H3TB1, AI3-00066, CHEBI:4893, butanoic acid, 3-oxo-ethyl ester, XYIBRDXRRQCHLP-UHFFFAOYSA-N, Ethyl acetoacetate, 99%, pure, Ethyl acetoacetate, 99+%, extra pure, Acetoacetic acid ethylester, ethylacetoaceate, ethyl acetoaceate, ethyl acetoacetat, ethyl acetoactate, etyl acetoacetate, Ethyl actoacetate, ethyl aceto acetate, EAC, Ethyl acetoacetate;, Ethyl-3-oxobutyrate, ethyl 3-oxo-butyrate, ethyl 3-oxo-butanoate, ethyl-3-oxo-butanoate, acetoacetate ethyl ester, ethyl alpha-acetoacetate, ACMC-209cnd, AC1L1RUV, ethyl 3-keto-n-butanoate, Ethyl .beta.-ketobutyrate, Ethyl acetoacetate, 99%, DSSTox_CID_7092, bmse000944, EC 205-516-1, AC1Q1K3Y, AC1Q34NY, DSSTox_RID_78305, DSSTox_GSID_27092, SCHEMBL15500, Ethyl 3-hydroxy-2-butenoate, Ethyl acetoacetate, >=99%, KSC176S2B, WLN: 2OV1V1, CHEMBL169176, Jsp002472, 3-oxo-butanoic acid ethyl ester, DTXSID2027092, 3-Oxobutanoic acid, ethyl ester, CTK0H6920, FEMA 2415, KS-00000UOO, NSC8657, NSC-8657, Tox21_200645, AC-671, AN-909, ANW-20663, BBL012204, SBB040867, STL163546, ZINC96014346, AKOS000118955, Ethyl acetoacetate, >=98.0% (GC), Ethyl acetoacetate, analytical standard, LS-2378, MCULE-8615117086, RP17313, RTR-032364, TRA0024628, Ethyl acetoacetate, >=99%, FCC, FG, NCGC00248778-01, NCGC00258199-01, AK163244, BC202411, CAS-141-97-9, SC-18922, Ethyl acetoacetate, natural, >=97%, FG, Ethyl acetoacetate, ReagentPlus(R), 99%, TR-032364, A0649, FT-0621773, ST50214457, C03500, 13021-EP2275395A2, 13021-EP2280012A2, 13021-EP2287165A2, 13021-EP2287166A2, 13021-EP2292615A1, 13021-EP2292620A2, 13021-EP2295438A1, 13021-EP2299785A1, 13021-EP2305825A1, 13021-EP2306788A1, 13021-EP2306789A1, 13021-EP2308838A1, 13021-EP2316831A1, 19134-EP2305668A1, 19134-EP2314576A1, Ethyl acetoacetate, Vetec(TM) reagent grade, 98%, Ethyl acetoacetate, Lonza quality, >=99.0% (GC), Ethyl acetoacetate, puriss. p.a., >=99.0% (GC), J-007572, J-520902, S14-1425, F1908-0178, InChI=1/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H, acetoacetate, Acetacetic ether, ETHYLACETOACETATE, Acetethansaureethylester, EAA (CHRIS Code), 3-Oxobutansaureethylester, Ethyl acetoacetate (EAA), Butanoic acid, ethyl ester, Ethyl acetoacetate sodium salt, Ethyl acetoacetate, 99% 500g, CID8868, AR-1H6421, C6-H10-O3, NA1993, UN1993, CS-T-54373, Ethyl acetoacetate, 99% - 100G 100g, Ethyl Acetoacetate 98% for synthesis 500ml, 1435-12-7, 1522-29-8, 4433-85-6,

Complexity	118
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	130.063g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	130.143g/mol
Monoisotopic Mass	130.063g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H227-H302-H315-H319-H335
Packing Group
Precautionary statements	P210-P261-P280-P305+P351+P338-P403+P235
UN Code	\N

Certificate of Analysis

Lot Number