AG00I4BH

220497-79-0 | D-Phenylalanine,2-bromo-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-

AG00I4BH

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CAS Number	220497-79-0
Catalog Number	AG00I4BH(AGN-PC-0QYLXO)
Chemical Name	D-Phenylalanine,2-bromo-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
IUPAC Name	(2R)-3-(2-bromophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI	InChI=1S/C24H20BrNO4/c25-21-12-6-1-7-15(21)13-22(23(27)28)26-24(29)30-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,22H,13-14H2,(H,26,29)(H,27,28)/t22-/m1/s1
InChI Key	GRJPAUULVKPBHU-JOCHJYFZSA-N
MDL Number	MFCD01311770
Molecular Formula	C24H20BrNO4
Molecular Weight	466.3239
SMILES	O=C(O)[C@@H](CC1=CC=CC=C1Br)NC(OCC2C3=CC=CC=C3C4=CC=CC=C24)=O
Synonyms	220497-79-0, Fmoc-2-bromo-D-phenylalanine, Fmoc-D-2-Bromophenylalanine, FMOC-D-2-BROMOPHE, (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-bromophenyl)propanoic acid, (2R)-3-(2-bromophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid, Fmoc-D-phe(2-Br)-OH, AK-81184, FMOC-D-2-BR-PHE-OH, N-Fmoc-2-bromo-D-phenylalanine, SCHEMBL19678478, CTK8C5108, DTXSID40426503, (R)-2-(((9H-FLUOREN-9-YL)METHOXY)CARBONYLAMINO)-3-(2-BROMOPHENYL)PROPANOIC ACID, ZINC2243700, ZX-AT014499, ANW-74143, CF-354, MFCD01311770, AKOS015837425, AB08471, AC-9634, AM82705, OR14555, RTR-010378, AJ-34377, CC-28681, DS-16152, SC-10509, AX8001624, TL8006307, TR-010378, FT-0644032, 497F790, C-22654, 2-bromo-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-phenylalanine, D-Phenylalanine,2-bromo-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, (2R)-3-(2-bromophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid, (2R)-3-(2-bromophenyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid, (2R)-3-(2-bromophenyl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid, CID7006559, 220497-47-2, (2S)-3-(2-bromophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic Acid, 220497-81-4,

Complexity	592
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	465.058g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	466.331g/mol
Monoisotopic Mass	465.058g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.3

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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