AG001DTC

146256-98-6 | 1,3-Pyrrolidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 3-ethyl ester

AG001DTC

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CAS Number	146256-98-6
Catalog Number	AG001DTC(AGN-PC-0NBXYK)
Chemical Name	1,3-Pyrrolidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 3-ethyl ester
IUPAC Name	1-O-tert-butyl 3-O-ethyl 4-oxopyrrolidine-1,3-dicarboxylate
InChI	InChI=1S/C12H19NO5/c1-5-17-10(15)8-6-13(7-9(8)14)11(16)18-12(2,3)4/h8H,5-7H2,1-4H3
InChI Key	CWRFSVAKVCSOPI-UHFFFAOYSA-N
MDL Number	MFCD06656201
Molecular Formula	C12H19NO5
Molecular Weight	257.2830
SMILES	O=C(OC(C)(C)C)N1CC(=O)C(C(=O)OCC)C1
Synonyms	146256-98-6, 1-tert-butyl 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate, Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate, 4-Oxo-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester 3-ethyl ester, ETHYL 1-BOC-4-OXOPYRROLIDINE-3-CARBOXYLATE, EthylN-Boc-4-Oxopyrrolidine-3-carboxylate, Ethyl N-Boc-4-oxo-pyrrolidine-3-carboxylate, MFCD06656201, AK-33315, W-205634, W-205635, 4-Oxopyrrolidine-1,3-dicarboxylic Acid 1-tert-Butyl 3-Ethyl Ester, O1-TERT-BUTYL O3-ETHYL 4-OXOPYRROLIDINE-1,3-DICARBOXYLATE, 1,3-Pyrrolidinedicarboxylic acid 4-oxo-1-(1,1-dimethylethyl) 3-ethyl ester, PubChem23165, ACMC-209zne, KSC496Q6J, SCHEMBL1224464, Jsp002690, CTK3J6864, DTXSID50446535, CWRFSVAKVCSOPI-UHFFFAOYSA-N, ACN-S002899, BCP22274, CS-D0932, ZX-RL004399, ANW-50472, CE-738, RW3310, AKOS005137942, AC-2936, AS-5158, CB-2032, PB23459, QC-1765, RP07572, RTC-060789, TRA0036752, VP60241, KS-000001S5, AN-13461, BC223573, OR300645, SC-12029, SY003381, AB0001792, AB1001597, AX8129434, BB0263135, DB-050627, ST1030174, TC-060789, A3187, AM20080352, BB 0263135, FT-0649916, W3195, O57032, X-1173, MFCD06656201 (95+%), 256B986, 1-(tert-butyl) 3-ethyl 4-oxopyrrolidine-1,3-dicarboxylate, Ethyl 1-tert-butyloxycarbonyl-4-oxopyrrolidine-3-carboxylate, 4-oxo-pyrrolidine-1,3-dicarboxylic acid 1-tert. butylester 3-ethylester, (RS)-4-oxo-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester 3-ethyl ester, 1,3-Pyrrolidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 3-ethyl ester, 1,3-Pyrrolidinedicarboxylicacid, 4-oxo-, 1-(1,1-dimethylethyl) 3-ethyl ester, null, C12H19NO5, CID10868942, 2-CYCLOPROPYLMETHOXY-5-IODOPYRIDINE, B4658, Tert-butyl Ethyl 4-oxopyrrolidine-1,3-dicarboxylate, 4-chloro-5-methoxy-2-methyl-2,3-dihydropyridazin-3-one, 1-tert-Butyl-3-ethyl-4-oxopyrrolidine-1,3-dicarboxylate, 98% - 1G 1g, Ethyl N-Boc-4-Oxopyrrolidine-3-carboxylate;1,3-Pyrrolidinedicarboxylic acid, 4-oxo-, 1-(1,1-dimethylethyl) 3-ethyl ester,

Complexity	358
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.126g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	257.286g/mol
Monoisotopic Mass	257.126g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	72.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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