AG002QWY

252049-14-2 | Fmoc-D-4-tert-butyl-Phe

AG002QWY

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CAS Number	252049-14-2
Catalog Number	AG002QWY(AGN-PC-0O89N4)
Chemical Name	Fmoc-D-4-tert-butyl-Phe
IUPAC Name	(2R)-3-(4-tert-butylphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI	InChI=1S/C28H29NO4/c1-28(2,3)19-14-12-18(13-15-19)16-25(26(30)31)29-27(32)33-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,29,32)(H,30,31)/t25-/m1/s1
InChI Key	OKEORFXNCSRZFL-RUZDIDTESA-N
MDL Number	MFCD02094467
Molecular Formula	C28H29NO4
Molecular Weight	443.5342
SMILES	O=C(O)[C@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CC4=CC=C(C(C)(C)C)C=C4
Synonyms	252049-14-2, FMOC-D-4-TERT-BUTYL-PHE, (R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(tert-butyl)phenyl)propanoic acid, Fmoc-4-tert-butyl-D-Phenylalanine, FMOC-D-PHE(4-TBU)-OH, D-Phenylalanine, 4-(1,1-dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, C28H29NO4, Fmoc-D-4-tButylphenylalanine, FMOC-P-TBU-D-PHE-OH, CTK1A1632, DTXSID40426644, (2R)-3-(4-tert-butylphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid, Fmoc-D-4-tert-butyl-phenylalanine, ZINC2389731, ZX-AT014649, 1998AB, MFCD02094467, AB10900, FMOC-4-T-BUTYL-D-PHENYLALANINE, OR14625, AC-25348, ACM252049142, AJ-35612, PS-12161, AX8032879, 4-tert-Butyl-N-{[(9H-fluoren-9-yl)methoxy]carbonyl}-D-phenylalanine, (2R)-3-(4-tert-butylphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid, (2R)-3-(4-tert-butylphenyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid, (2R)-3-(4-tert-butylphenyl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid, (R)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3-(4-tert-butylphenyl)propanoic acid, 4-(1,1-dimethylethyl)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-phenylalanine, CID7010381, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-tert-butylphenyl)propanoic Acid, 213383-02-9,

Complexity	656
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	443.21g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	443.543g/mol
Monoisotopic Mass	443.21g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
UN Code

Certificate of Analysis

Lot Number