AG002RUC

261380-20-5 | Boc-(r)-3-amino-3-(4-bromo-phenyl)-propionic acid

AG002RUC

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CAS Number	261380-20-5
Catalog Number	AG002RUC(AGN-PC-0R21GB)
Chemical Name	Boc-(r)-3-amino-3-(4-bromo-phenyl)-propionic acid
IUPAC Name	(3R)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI	InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(8-12(17)18)9-4-6-10(15)7-5-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChI Key	ZAMLGGRVTAXBHI-LLVKDONJSA-N
MDL Number	MFCD01320860
Molecular Formula	C14H18BrNO4
Molecular Weight	344.2010
SMILES	BrC1=CC=C(C=C1)[C@@H](CC(=O)O)NC(=O)OC(C)(C)C
Synonyms	261380-20-5, Boc-(R)-3-Amino-3-(4-bromo-phenyl)-propionic acid, Boc-4-bromo-L-beta-phenylalanine, (R)-3-(4-Bromophenyl)-3-((tert-butoxycarbonyl)amino)propanoic acid, MFCD01320860, (R)-Boc-4-bromo-beta-Phe-OH, Boc-(R)-4-beta-bromophenylalanine, (R)-3-(Boc-amino)-3-(4-bromophenyl)propionic acid, BOC-P-BROMO-D-BETA-PHENYLALANINE, (R)-N-Boc-3-Amino-3-(4-bromophenyl)propanoic acid, Boc-4-bromo-L-|A-phenylalanine, (R)-N-BOC-3-Amino-3-(4-bromophenyl)propanoic acid, 95%, 98% ee, Boc-beta-(R)-4-bromophenylalanine, PubChem17334, Boc-D-?-Phe(4-Br)-OH, SCHEMBL2794893, (R)-Boc-4-bromo-|A-Phe-OH, DTXSID60426540, (3R)-3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, ZAMLGGRVTAXBHI-LLVKDONJSA-N, ZINC2379440, CB-774, AB09023, BENZENEPROPANOIC ACID, 4-BROMO-BETA-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-, (BETAR)-, AC-22020, ACM261380205, AJ-34581, AK114808, AS-36289, BBV-38259727, BC004226, BC208725, AB0020213, AX8019780, BOC-(R)-4-BROMO-BETA-PHENYLALANINE, TL8006342, FT-0656307, ST24044084, V1034, K-6774, 380B205, (R)-Boc-4-bromo-beta-Phe-OH, >=98.0% (HPLC), (R)-N-BOC-BETA-(4-BROMOPHENYL)-BETA-ALANINE, (R)-3-(4-bromophenyl)-3-(tert-butoxycarbonylamino)propanoic acid, N-BETA-(T-BUTOXYCARBONYL)-4-BROMO-L-BETA-HOMOPHENYLGLYCINE, (3R)-3-(4-Bromophenyl)-3-[(tert-butoxycarbonyl)amino]propanoic acid, (R)-3-(4-BROMO-PHENYL)-3-TERT-BUTOXYCARBONYLAMINO-PROPIONIC ACID, (R)-N-TERT-BUTOXYCARBONYL-3-AMINO-3-(4-BROMOPHENYL)PROPANOIC ACID, C14H18BrNO4, Boc-4-bromo-D-beta-phenylalanine, 5,6-Difluoroisoindoline-1,3-dione, ACN-025964, CB11782, CID7009110, Boc-(S)-3-Amino-3-(4-bromophenyl)-propionic acid, (R)-3-(4-Bromophenyl)-3-((tert-butoxycarbonyl)amino)propanoicacid, (R)-3-(Boc-amino)-3-(4-bromophenyl)propionic acid, 98% - 1G 1g, 261165-06-4, 3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid, 83684-73-5,

Complexity	346
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	343.042g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	344.205g/mol
Monoisotopic Mass	343.042g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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