AG0034XT

118904-37-3 | N-(9-Fluorenylmethyloxycarbonyl)-D-allo-isoleucine

AG0034XT

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CAS Number	118904-37-3
Catalog Number	AG0034XT(AGN-PC-0NZPLW)
Chemical Name	N-(9-Fluorenylmethyloxycarbonyl)-D-allo-isoleucine
IUPAC Name	(2R,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylpentanoic acid
InChI	InChI=1S/C21H23NO4/c1-3-13(2)19(20(23)24)22-21(25)26-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,13,18-19H,3,12H2,1-2H3,(H,22,25)(H,23,24)/t13-,19+/m0/s1
InChI Key	QXVFEIPAZSXRGM-ORAYPTAESA-N
MDL Number	MFCD00077062
Molecular Formula	C21H23NO4
Molecular Weight	353.4116
SMILES	CC[C@H](C)[C@H](C(O)=O)NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O
Synonyms	118904-37-3, Fmoc-d-allo-ile-oh, FMOC-D-allo-Isoleucine, (2R,3S)-N-Fmoc-2-Amino-3-Methylpentanoic Acid, Fmoc-D-allo-lle-OH, (2R,3S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-methylpentanoic acid, MFCD00077062, D-Alloisoleucine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, (2R,3S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-methylpentanoic acid, AK-49297, PubChem15619, CTK3J8315, KS-00000ABR, DTXSID30426315, ACT07992, ZINC1576225, ANW-41685, AKOS015950970, AM81865, CS-W022725, DS-2293, FCH2718413, AJ-27293, SC-09620, AB0004826, AB1006943, AX8030429, RT-004508, ST2402237, FT-0689537, B-6586, 904F373, A804124, C-54863, N-(9-Fluorenylmethyloxycarbonyl)-D-allo-isoleucine, N-(9H-Fluoren-9-ylmethoxycarbonyl)-D-alloisoleucine, N-alpha-(9-Fluorenylmethyloxycarbonyl)-D-allo-isoleucine, (2R,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methyl-pentanoic acid, (2R,3S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylpentanoic acid, (2R,3S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)-amino)-3-methylpentanoic acid, (2R,3S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3-methylpentanoic acid, (2R,3S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-methylpentanoic acid, null, Fmoc-D-Allo-Ile-OH - 1G 1g, NSC334289, CB10124, CID6992517, A7911, N-[(9H-Fluoren-9-yl)methoxycarbonyl]-D-alloisoleucine,

Complexity	486
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	353.163g/mol
Formal Charge	0
Heavy Atom Count	26
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	353.418g/mol
Monoisotopic Mass	353.163g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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