AG003OGU

69355-99-3 | Boc-D-Thr(Bzl)-OH

AG003OGU

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CAS Number	69355-99-3
Catalog Number	AG003OGU(AGN-PC-0OGR47)
Chemical Name	Boc-D-Thr(Bzl)-OH
IUPAC Name	(2R,3S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxybutanoic acid
InChI	InChI=1S/C16H23NO5/c1-11(21-10-12-8-6-5-7-9-12)13(14(18)19)17-15(20)22-16(2,3)4/h5-9,11,13H,10H2,1-4H3,(H,17,20)(H,18,19)/t11-,13+/m0/s1
InChI Key	CTXPLTPDOISPTE-WCQYABFASA-N
MDL Number	MFCD00038247
Molecular Formula	C16H23NO5
Molecular Weight	309.3575
SMILES	C[C@H](OCC1=CC=CC=C1)[C@@H](NC(=O)OC(C)(C)C)C(O)=O
Synonyms	Boc-D-Thr(Bzl)-OH, 69355-99-3, Boc-O-benzyl-D-threonine, (2R,3S)-3-(Benzyloxy)-2-((tert-butoxycarbonyl)amino)butanoic acid, MFCD00038247, BOC-D-Thr(OBzl), PubChem12446, N-Boc-D-Thr(Bzl)-OH, SCHEMBL1414711, CTK3J1708, CTXPLTPDOISPTE-WCQYABFASA-N, CS-B0830, ZINC1576313, CB-359, KM1259, AKOS015924179, AM90229, RTR-023079, AJ-27324, DB-022903, TR-023079, FT-0629751, ST24034011, V1153, Boc-D-Thr(Bzl)-OH, >=98.0% (TLC), N-(Tert-Butoxycarbonyl)-O-Benzyl-D-Threonine, O-Benzyl-N-(tert-butyloxycarbonyl)-D-threonine, N-alpha-t-Butyloxycarbonyl-O-benzyl-D-threonine, 355B993, I01-5152, (2R,3S)-3-(benzyloxy)-2-(tert-butoxycarbonylamino)butanoic acid, (2R,3S)-3-benzyloxy-2-(tert-butoxycarbonyl-amino)-butanoic acid, D-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-, Boc-Thr(Bzl)-OH, Boc-O-benzyl-L-threonine, N- -O-benzyl-D-threonine, C16H23NO5, Boc-D-Thr(Bzl)-OH - 5G 5g, NSC334365, CID6992573, A7841, 15260-10-3, D-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-; N-(tert-Butoxycarbonyl)-O-benzyl-D-threonine,

Complexity	371
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	309.158g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	309.362g/mol
Monoisotopic Mass	309.158g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	84.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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