AG00131F

13726-84-6 | L-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, 5-(1,1-dimethylethyl) ester

AG00131F

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CAS Number	13726-84-6
Catalog Number	AG00131F(AGN-PC-0PLBCK)
Chemical Name	L-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-, 5-(1,1-dimethylethyl) ester
IUPAC Name	(2S)-5-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
InChI	InChI=1S/C14H25NO6/c1-13(2,3)20-10(16)8-7-9(11(17)18)15-12(19)21-14(4,5)6/h9H,7-8H2,1-6H3,(H,15,19)(H,17,18)/t9-/m0/s1
InChI Key	YGSRAYJBEREVRB-VIFPVBQESA-N
MDL Number	MFCD00038257
Molecular Formula	C14H25NO6
Molecular Weight	303.3514
SMILES	O=C(OC(C)(C)C)CC[C@@H](C(O)=O)NC(OC(C)(C)C)=O
Synonyms	Boc-Glu(OtBu)-OH, 13726-84-6, Boc-L-Glu(OtBu)-OH, (S)-5-(tert-Butoxy)-2-((tert-butoxycarbonyl)amino)-5-oxopentanoic acid, MFCD00038257, Boc-L-glutamic acid 5-tert-butyl ester, YGSRAYJBEREVRB-VIFPVBQESA-N, N-Boc-L-Glutamic Acid 5-Tert-Butyl Ester, J-300112, Q-101802, N-tert-Butoxycarbonyl-L-glutamic acid gamma-tert-butyl ester, AK-49371, Boc-Glu(OtBu), AC1ODTMW, PubChem18923, Boc-Glu(O-tBu)-OH, N-t-Butyloxycarbonyl-L-glutamic acid gamma-t-butyl ester, KSC496A6J, SCHEMBL617476, CTK3J6064, KS-00000AAL, ZINC1640076, ANW-43367, AKOS015922884, CB-1670, CS-W009945, RL01642, RTR-004968, AJ-28562, AS-12987, SC-09490, AB0012774, AB1002089, AX8018181, ST2408337, TR-004968, FT-0657311, B-7205, 726B846, tert-butoxycarbonyl-L-glutamic acid 5-tert-butyl ester, 5-tert-Butoxy-N-(tert-butoxycarbonyl)-5-oxonorvaline #, Boc-Glu(OtBu)-OH, >=99.0% (sum of enantiomers, TLC), N-(tert-Butyloxycarbonyl)glutamic acid 5-tert-butyl ester, N-.alpha.-t-Butoxycarbonyl-L-glutamic-.gamma.-t-butyl ester, N-alpha-t-Butyloxycarbonyl-L-glutamic acid-gamma-t-butyl ester, (5)-5-tert-butoxy-2-(tert-butoxycarbonylamino)-5-oxopentanoic acid, (S)-2-tert-butoxycarbonylamino-pentanedioic acid 5-tert-butyl ester, (S)-5-tert-butoxy-2-(tert-butoxycarbonylamino)-5-oxopentanoic acid, (2S)-5-(tert-butoxy)-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid, (2S)-5-tert-butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid, (2S)-5-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid, C14H25NO6, Boc-Glu(OtBu)-OH - 5G 5g, NSC164048, ACN-033162, CID6993432, A7762, (2S)-5-tert-Butoxy-2-[(tert-butoxycarbonyl)amino]-5-oxopentanoic acid; (S)-5-tert-Butoxy-2-(tert-butoxycarbonylamino)-5-oxopentanoic acid; N-Boc-L-glutamic acid r-(tert-butyl) ester,

Complexity	391
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	303.168g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	303.355g/mol
Monoisotopic Mass	303.168g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

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

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