AG0034UI

609-15-4 | Ethyl 2-chloroacetoacetate

AG0034UI

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CAS Number	609-15-4
Catalog Number	AG0034UI(AGN-PC-0JKA9J)
Chemical Name	Ethyl 2-chloroacetoacetate
EC Number	210-180-4
IUPAC Name	ethyl 2-chloro-3-oxobutanoate
InChI	InChI=1S/C6H9ClO3/c1-3-10-6(9)5(7)4(2)8/h5H,3H2,1-2H3
InChI Key	RDULEYWUGKOCMR-UHFFFAOYSA-N
MDL Number	MFCD00009141
Molecular Formula	C6H9ClO3
Molecular Weight	164.5869
NSC Number	78426
SMILES	ClC(C(=O)OCC)C(=O)C
Synonyms	A 21960, A-21960, Ethyl 2-chloroacetoacetate, 609-15-4, Ethyl 2-chloro-3-oxobutanoate, 2-Chloroacetoacetic acid ethyl ester, Butanoic acid, 2-chloro-3-oxo-, ethyl ester, Ethyl alpha-chloroacetoacetate, Ethyl-2-chloracetoacetate, 2-Chloro-3-oxobutyric acid ethyl ester, 2-Chloro-3-oxobutanoic acid, ethyl ester, NSC 78426, ethyl2-chloro-3-oxobutanoate, Ethyl 2-chloro-3-oxobutyrate, CCRIS 6889, Acetoacetic acid, 2-chloro-, ethyl ester, Ethyl2-chloroacetoacetate, Ethyl 2-chloracetoacetate, EINECS 210-180-4, MFCD00009141, A 21960, Ethyl .alpha.-chloroacetoacetate, RDULEYWUGKOCMR-UHFFFAOYSA-N, 2-chloro-3-oxo-butyric acid ethyl ester, Ethyl 2-chloroacetoacetate, 90%, AC1L1YAO, ethyl 2-choroacetoacetate, ethyl-2-chloroacetoacetate, ACMC-209mn7, EC 210-180-4, ethyl 2-chloro-acetoacetate, Ethyl 2-chloroaceto-acetate, ethyl-2-chloro-acetoacetate, DSSTox_CID_29286, DSSTox_RID_83405, DSSTox_GSID_49330, SCHEMBL54869, ethyl-2-chloro-3oxobutanoate, ethyl 2-chloro-3-oxobutanate, Ethyl-alpha-Chloroacetoacetate, KSC493O4P, ethyl-2-chloro-3-oxobutanoate, AC1Q324F, Ethyl 2-chloro-3-oxo-butyrate, CHEMBL3186400, DTXSID3049330, alphachloroacetoacetic ethyl ester, CTK3J3747, Ethyl 2-chloroacetoacetate, 95%, ACT06649, BCP17354, EBD28974, KS-00000C1X, NSC78426, Tox21_202936, ANW-33617, NSC-78426, SBB040841, STL193992, AKOS000269010, AKOS016039405, ACN-000260, CS-W018512, MCULE-6187451142, RP22742, TRA0047685, ETHYL 2-CHLORO-3-OXO-BUTANOATE, NCGC00260482-01, AK-65251, AN-46416, BR-65251, CAS-609-15-4, SC-46895, DB-013417, LS-188170, RT-001673, ST2412931, FT-0611898, ST50214424, Acetoacetic acid, 2-chloro-, ethyl ester (8CI), I14-0400, F2190-0285, Ethyl 2-chloroacetoacetate, produced by Wacker Chemie AG, Burghausen, Germany, >=96% (GC), C6H9ClO3, Butanoic acid, ethyl ester, acetoacetic acid, ethyl ester, C6-H9-Cl-O3, CID11858, c1218, Ethyl 2-chloroacetoacetate, 96% 100g, A8472, Ethyl 2-chloroacetoacetate, 96% - 100G 100g,

Complexity	144
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.024g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.585g/mol
Monoisotopic Mass	164.024g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8(3)
Hazard statements	H226-H302-H315-H318-H335-H412
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 2920

Certificate of Analysis

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