AG0034SC

85916-13-8 | Di-tert-butyl iminodiacetate

AG0034SC

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CAS Number	85916-13-8
Catalog Number	AG0034SC(AGN-PC-0LACYX)
Chemical Name	Di-tert-butyl iminodiacetate
IUPAC Name	tert-butyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate
InChI	InChI=1S/C12H23NO4/c1-11(2,3)16-9(14)7-13-8-10(15)17-12(4,5)6/h13H,7-8H2,1-6H3
InChI Key	SMXMBXPLRFTROI-UHFFFAOYSA-N
MDL Number	MFCD01863672
Molecular Formula	C12H23NO4
Molecular Weight	245.3153
SMILES	O=C(OC(C)(C)C)CNCC(=O)OC(C)(C)C
Synonyms	Di-tert-butyl iminodiacetate, 85916-13-8, Di-tert-butyl 2,2'-azanediyldiacetate, di-t-butyl iminodiacetate, AK-50178, tert-butyl 2-{[2-(tert-butoxy)-2-oxoethyl]amino}acetate, tert-butyl 2-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]acetate, DI-TERT-BUTYLIMINODIACETATE, di-t-butyliminodiacetate, AC1N9ZHM, AC1Q1MQI, ACMC-209q7s, Di(t-butyl) 3-azaglutarate, SCHEMBL783009, CTK5F5970, DTXSID00402803, SMXMBXPLRFTROI-UHFFFAOYSA-N, di-tert-butyl 2,2'-iminodiacetate, ACT03406, Di-tert-butyl iminodiacetate, 98%, tert-butyl 2,2'-azanediyldiacetate, Bis(2-oxo-2-tert-butoxyethyl)amine, ANW-38246, MFCD01863672, ZINC34856085, AKOS015900315, Di-tert-butyl 2,2'-iminobis[acetate], Iminodiacetic Acid Di-tert-butyl Ester, MCULE-6083628598, KS-0000129R, AJ-90267, BR-50178, AX8126180, TC-126991, D4109, FT-0689832, ST24030301, ST51038492, W8834, S-1916, I14-10700, tert-Butyl 2-[(2-tert-butoxy-2-oxo-ethyl)amino]acetate, tert-butyl 2-({[(tert-butyl)oxycarbonyl]methyl}amino)acetate, Glycine, N-[2-(1,1-dimethylethoxy)-2-oxoethyl]-, 1,1-dimethylethyl ester, Glycine,N-[2-(1,1-dimethylethoxy)-2-oxoethyl]-, 1,1-dimethylethyl ester, Di-?tert-?butyl iminodiacetate, C12H23NO4, CID4393691, Di-tert-butyl iminodiacetate, 98% - 1G 1g, Tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylmethylamino]acetate,

Complexity	245
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.163g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	245.319g/mol
Monoisotopic Mass	245.163g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	64.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number