AG0036DA

876317-19-0 | N-Boc-4-oxo-DL-Proline

AG0036DA

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CAS Number	876317-19-0
Catalog Number	AG0036DA(AGN-PC-00CA3P)
Chemical Name	N-Boc-4-oxo-DL-Proline
IUPAC Name	1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxopyrrolidine-2-carboxylic acid
InChI	InChI=1S/C10H15NO5/c1-10(2,3)16-9(15)11-5-6(12)4-7(11)8(13)14/h7H,4-5H2,1-3H3,(H,13,14)
InChI Key	CKYGSXRXTIKGAJ-UHFFFAOYSA-N
MDL Number	MFCD02668169
Molecular Formula	C10H15NO5
Molecular Weight	229.2298
SMILES	O=C1CN(C(C1)C(=O)O)C(=O)OC(C)(C)C
Synonyms	876317-19-0, 1-(tert-butoxycarbonyl)-4-oxopyrrolidine-2-carboxylic acid, 1-(tert-Butoxycarbonyl)-4-oxopyrrolidine-2-carboxylicacid, Boc-4-oxo-Pro-OH, AK-36667, 1-[(tert-butoxy)carbonyl]-4-oxopyrrolidine-2-carboxylic acid, 1-(tert-butoxycarbonyl)-4-oxoproline, AK-41307, ACMC-209pub, N-Boc-4-oxo-DL-Proline, KSC915G8R, SCHEMBL204966, (2S)-1-TERT-BUTYL HYDROGEN 4-OXOPYRROLIDINE-1,2-DICARBOXYLATE, CTK8B5388, DTXSID10399957, AC1N4801, BCP18625, KS-00000LV2, ANW-48558, MFCD02668169, AKOS015900150, FCH1620403, RP27818, TRA0063986, AC-26531, AK-64604, BR-36667, CS-10832, EN002359, OR300927, SY024343, AB0002513, AX8051865, ST2408622, TC-137303, 4CH-001789, 4CH-014361, FT-0650493, W8996, MFCD01860669 (97%), S-3802, I14-2077, I14-10875, 4-Oxo-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, (2S)-4-Oxopyrrolidine-2-carboxylic acid, N-BOC protected 97%, 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxopyrrolidine-2-carboxylic acid, N-Boc-4-oxo-L-proline, C10H15NO5, CID4150645, 84348-37-8, (2S)-4-oxopyrrolidine-2-carboxylic acid, (R)-1-(tert-Butoxycarbonyl)-4-oxopyrrolidine-2-carboxylic acid, A10132, 364077-84-9, (2S)-1-Tert-butyl-hydrogen-4-oxopyrrolidine-1,2-dicarboxylate, (S)-1-(Tert-Butoxycarbonyl)-4-oxopyrrolidine-2-carboxylic acid, 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxo-pyrrolidine-2-carboxylic Acid,

Complexity	331
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.095g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	229.232g/mol
Monoisotopic Mass	229.095g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	83.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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