AG002RTS

261360-77-4 | (R)-N-Boc-3-bromophenylalanine

AG002RTS

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CAS Number	261360-77-4
Catalog Number	AG002RTS(AGN-PC-0O8DH6)
Chemical Name	(R)-N-Boc-3-bromophenylalanine
IUPAC Name	(2R)-3-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI	InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(19)16-11(12(17)18)8-9-5-4-6-10(15)7-9/h4-7,11H,8H2,1-3H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChI Key	FBUDYESOPLBQIR-LLVKDONJSA-N
MDL Number	MFCD01317704
Molecular Formula	C14H18BrNO4
Molecular Weight	344.2010
SMILES	C([C@@H](NC(=O)OC(C)(C)C)C(=O)O)c1cc(Br)ccc1
Synonyms	261360-77-4, Boc-3-bromo-D-phenylalanine, (r)-n-boc-3-bromophenylalanine, Boc-D-3-Bromophenylalanine, (R)-3-(3-Bromophenyl)-2-((tert-butoxycarbonyl)amino)propanoic acid, BOC-D-3-BR-PHE-OH, MFCD01317704, D-Phenylalanine, 3-bromo-N-[(1,1-dimethylethoxy)carbonyl]-, (2R)-3-(3-bromophenyl)-2-[(tert-butoxycarbonyl)amino]propanoic acid, Q-101732, Boc-D-3-Bromophe, (R)-3-(3-BROMOPHENYL)-2-(TERT-BUTOXYCARBONYLAMINO)PROPANOIC ACID, (2R)-3-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, AK-49619, PubChem21069, (R)-BOC-2-AMINO-3-(3-BROMOPHENYL)PROPIONIC ACID, Boc-D-3-Bromo phenylalanine, BOC-D-PHE(3-BR)-OH, SCHEMBL3553426, (R)-3-(3-BROMO-PHENYL)-2-TERT-BUTOXYCARBONYLAMINO-PROPIONIC ACID, CTK8C5186, DTXSID00426509, (2R)-2-[(TERT-BUTOXY)CARBONYLAMINO]-3-(3-BROMOPHENYL)PROPANOIC ACID, FBUDYESOPLBQIR-LLVKDONJSA-N, KS-00000H7K, ZINC2244127, ANW-74501, CB-501, AKOS015836546, AB08561, AC-5855, AM82712, RTR-011825, AJ-34429, AS-37065, BC004623, SC-10516, SC-69640, AB0048297, AX8015500, TL8006339, TR-011825, CS-0043624, FT-0644145, ST24035426, K-6772, 360B774, C-20436, 3-bromo-N-[(1,1-dimethylethoxy)carbonyl]-D-phenylalanine, BOC-PHE(3-BR)-OH, Boc-D-phe(4-Br)-OH, -N-Boc-3-Bromophenylalanine, (R)-N-Boc-3-Bromo-beta-phenylalanine, ACN-033988, CID7006629, N-(TERT-BUTOXYCARBONYL)-D-3-BROMOPHENYLALANINE, 82278-73-7, 501015-16-3, 3-(3-bromophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid,

Complexity	354
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	3.2

GHS Hazard and Precautionary Statements

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

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