AG001CLU

14064-10-9 | Propanedioic acid, 2-chloro-, 1,3-diethyl ester

AG001CLU

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CAS Number	14064-10-9
Catalog Number	AG001CLU(AGN-PC-0JLUXW)
Chemical Name	Propanedioic acid, 2-chloro-, 1,3-diethyl ester
EC Number	237-913-0
IUPAC Name	diethyl 2-chloropropanedioate
InChI	InChI=1S/C7H11ClO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4H2,1-2H3
InChI Key	WLWCQKMQYZFTDR-UHFFFAOYSA-N
MDL Number	MFCD00009140
Molecular Formula	C7H11ClO4
Molecular Weight	194.6128
NSC Number	227952
SMILES	O=C(OCC)C(C(=O)OCC)Cl
UNII	8Y5J45M964
Synonyms	Diethyl chloromalonate, Diethyl 2-chloromalonate, 14064-10-9, Ethyl chloromalonate, Ethylmonochloromalonate, Propanedioic acid, chloro-, diethyl ester, diethyl chloropropanedioate, Chloromalonic acid, diethyl ester, diethyl 2-chloropropanedioate, Malonic acid, chloro-, diethyl ester, Propanedioic acid, 2-chloro-, 1,3-diethyl ester, UNII-8Y5J45M964, EINECS 237-913-0, NSC 227952, WLWCQKMQYZFTDR-UHFFFAOYSA-N, 1,3-diethyl 2-chloropropanedioate, 8Y5J45M964, Diethyl chloromalonate, 90%, Q-200972, diethylchloromalonate, ACMC-20a5gq, ClCH(COOC2H5)2, EC 237-913-0, AC1Q63YK, C7H11ClO4, Diethyl 2-chloromalonate #, 2-Chloromalonic acid diethyl, Diethyl chloromalonate, 95%, KSC493A0P, AC1L36Y4, chloromalonic acid diethyl ester, SCHEMBL1444159, Jsp002411, DTXSID2022258, CTK3J3007, WLWCQKMQYZFTDR-UHFFFAOYSA-, KS-00000Z9H, ZINC1757895, Chloropropanedioic acid diethyl ester, AN-700, ANW-58008, BBL103910, MFCD00009140, NSC227952, STL557720, AKOS015843271, CS-W010637, MCULE-7689614221, NSC-227952, OR46531, RP25333, RTC-020164, TRA0171818, AJ-31516, AK-59846, AS-40995, CJ-07039, CJ-29716, M281, SC-15237, AX8124663, DB-029655, LS-184961, TC-020164, FT-0637003, ST24030341, C-28285, I04-0576, F8889-0706, InChI=1/C7H11ClO4/c1-3-11-6(9)5(8)7(10)12-4-2/h5H,3-4H2,1-2H3, Malonic acid, diethyl ester, C7-H11-Cl-O4, Propanedioic acid, diethyl ester, Diethyl aminomalonate hydrochloride, CID84182, AR-1I4648, Diethyl chloromalonate, 90% - 100G 100g, Diethyl chloromalonate, 98% - 100G 100g, 142276-30-0,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.035g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.611g/mol
Monoisotopic Mass	194.035g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H317-H319
Packing Group	Ⅱ
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code	UN 3265

Certificate of Analysis

Lot Number