AG0035D4

32926-43-5 | (S)-L-Boc-His(Trt)-OH

AG0035D4

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CAS Number	32926-43-5
Catalog Number	AG0035D4(AGN-PC-0O8YT4)
Chemical Name	(S)-L-Boc-His(Trt)-OH
IUPAC Name	(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-tritylimidazol-4-yl)propanoic acid
InChI	InChI=1S/C30H31N3O4/c1-29(2,3)37-28(36)32-26(27(34)35)19-25-20-33(21-31-25)30(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,20-21,26H,19H2,1-3H3,(H,32,36)(H,34,35)/t26-/m0/s1
InChI Key	OYXZPXVCRAAKCM-SANMLTNESA-N
MDL Number	MFCD00153307
Molecular Formula	C30H31N3O4
Molecular Weight	497.5848
SMILES	[H]C(NC(=O)OC(C)(C)C)(C(=O)O)Cc1ncn(c1)C(c2ccccc2)(c3ccccc3)c4ccccc4
Synonyms	Boc-His(Trt)-OH, 32926-43-5, N-Boc-N'-trityl-L-histidine, (S)-2-((tert-Butoxycarbonyl)amino)-3-(1-trityl-1H-imidazol-4-yl)propanoic acid, Q-101821, C30H31N3O4, L-Histidine, N-[(1,1-dimethylethoxy)carbonyl]-1-(triphenylmethyl)-, N|A-Boc-N(im)-trityl-L-histidine, (S)-L-Boc-His(Trt)-OH, SCHEMBL9959535, N-Boc-N\'-trityl-L-histidine, KS-00000KIU, EBD6935, ACT10790, N-|A-Boc-N-im-trityl-L-histidine, MFCD00153307, ZINC25783998, AKOS015903518, AM81820, CB-1675, DS-2286, AJ-82130, AK-44645, AX8033235, Boc-His(Trt)-OH, >=98.0% (TLC), DB-030155, FT-0686530, ST24033142, X3372, J3.560.619J, M-8187, 926B435, 1-Trityl-Nalpha-(tert-butyloxycarbonyl)-L-histidine, I14-18811, N-alpha-t-Butyloxycarbonyl-N-im-t-trityl-L-histidine, (S)-2-(Boc-amino)-3-(1-trityl-4-imidazolyl)propionic acid, 95%, (S)-2-(tert-butoxycarbonylamino)-3-(1-trityl-1H-imidazol-4-yl)propanoic acid, (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-[1-(triphenylmethyl)-1H-imidazol-4-yl]propanoic acid, Boc-L-His(Trt)-OH, N-alpha-Boc-N-im-trityl-L-histidine, ACN-033268, Boc-His(Trt)-OH, 98% - 1G 1g, N-Boc-N'-trityl-L-histidine; L-Histidine, N-[(1,1-dimethylethoxy)carbonyl]-1-(triphenylmethyl)-,

Complexity	703
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	497.231g/mol
Formal Charge	0
Heavy Atom Count	37
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	497.595g/mol
Monoisotopic Mass	497.231g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	93.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.4

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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