AG003Q41

607-97-6 | Ethyl 2-ethyl-3-oxobutanoate

AG003Q41

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CAS Number	607-97-6
Catalog Number	AG003Q41(AGN-PC-07Y469)
Chemical Name	Ethyl 2-ethyl-3-oxobutanoate
EC Number	210-151-6
IUPAC Name	ethyl 2-ethyl-3-oxobutanoate
InChI	InChI=1S/C8H14O3/c1-4-7(6(3)9)8(10)11-5-2/h7H,4-5H2,1-3H3
InChI Key	OKANYBNORCUPKZ-UHFFFAOYSA-N
MDL Number	MFCD00039898
Molecular Formula	C8H14O3
Molecular Weight	158.1950
NSC Number	53775
SMILES	CC(C(CC)C(OCC)=O)=O
Synonyms	Ethyl 2-ethylacetoacetate, 607-97-6, Ethyl 2-ethyl-3-oxobutanoate, Ethyl 2-acetylbutyrate, 2-Ethylacetoacetic Acid Ethyl Ester, Butanoic acid, 2-ethyl-3-oxo-, ethyl ester, Ethyl 2-ethyl-3-ketobutyrate, Ethyl alpha-ethylacetoacetate, ethyl-2-ethylacetoacetate, MFCD00039898, NSC 53775, 2-ethyl-3-oxo-butyric acid ethyl ester, Ethyl .alpha.-acetylbutyrate, ethyl 2-ethyl-3-oxo-butanoate, Ethyl .alpha.-ethylacetoacetate, Ethyl 2-ethylacetoacetate, 90%, OKANYBNORCUPKZ-UHFFFAOYSA-N, Ethyl alpha-acetylbutyrate, EINECS 210-151-6, Ethyl ethylacetoacetate, Acetoacetic acid, 2-ethyl-, ethyl ester, AI3-06006, AC1L2WKV, ethyl-2 ethylacetoacetate, ACMC-1B1SB, ethyl 2-ethyl-acetoacetate, ethyl 2-ethyl-3-oxobutyrate, ARONIS24211, SCHEMBL856078, ethyl 2-ethyl-3-oxo-butyrate, AC1Q322N, CTK5B2274, Ethyl 2-ethyl-3-oxobutanoate #, 2-Acetylbutyric Acid Ethyl Ester, 2-Ethyl-3-oxobutyric acid ethyl, KS-00000FB9, NSC53775, ANW-33578, NSC-53775, SBB079228, STL185642, AKOS000120029, AKOS016042090, CS-W008164, MCULE-7868546169, RL04287, TRA0084084, VZ32052, 2-Ethyl-3-oxobutanoic acid ethyl ester, AK-46785, AN-46393, AS-18443, BR-46785, SC-17640, SY021467, Butanoic acid,2-ethyl-3-oxo-, ethyl ester, DB-053706, ST2412941, TR-020953, AM20100476, BB 0259255, E0895, FT-0612245, W7319, M-9506, Acetoacetic acid, 2-ethyl-, ethyl ester (8CI), MFCD00039898 (95+%), I14-7461, W-105229, F0001-1590, Butanoic acid, ethyl ester, acetoacetic acid, ethyl ester, C8H14O3, CID79065, C8-H14-O3, Ethyl 2-ethylacetoacetate, 95% - 100G 100g, 36847-10-6,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.094g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	158.197g/mol
Monoisotopic Mass	158.094g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number