AG000DQQ

117106-21-5 | Butanoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-

AG000DQQ

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CAS Number	117106-21-5
Catalog Number	AG000DQQ(AGN-PC-0PA0YQ)
Chemical Name	Butanoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-
IUPAC Name	(2S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI	InChI=1S/C24H28N2O6/c1-24(2,3)32-23(30)26-20(21(27)28)12-13-25-22(29)31-14-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,19-20H,12-14H2,1-3H3,(H,25,29)(H,26,30)(H,27,28)/t20-/m0/s1
InChI Key	MJZDTTZGQUEOBL-FQEVSTJZSA-N
MDL Number	MFCD00236845
Molecular Formula	C24H28N2O6
Molecular Weight	440.4889
SMILES	O=C(O)[C@@H](NC(OC(C)(C)C)=O)CCNC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O
Synonyms	Boc-Dab(Fmoc)-OH, 117106-21-5, MFCD00236845, Boc-L-2,4-Diaminobutyric acid(Fmoc), (S)-4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)butanoic acid, (S)-N2-Boc-N4-Fmoc-2,4-diaminobutyric Acid, (2S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid, AK-49288, Boc-Dbu(gamma-Fmoc);, Boc-L-Dab(Fmoc)-OH, AC1MBSG1, N-a-Boc-N-g-Fmoc-L-2,4-diaminobutyric acid, SCHEMBL1000910, MJZDTTZGQUEOBL-FQEVSTJZSA-N, KS-00000K9Q, ZINC2560681, ZX-AT014704, 2788AA, AKOS015901248, CS-W011602, EBD2207906, FCH3668338, OR14668, AJ-40620, DS-15008, AX8030391, N-BoC-N'-FmoC-L-2,4-diaminobutyric acid, Boc-Dab(Fmoc)-OH, >=98.0% (HPLC), FT-0697378, ST24036159, N|A-Boc-N|A-Fmoc-L-2,4-diaminobutyric acid, N-alpha-Boc-N-gamma-Fmoc-L-Diaminobutyric acid, (S)-2-(Boc-amino)-4-(Fmoc-amino)-butanoic acid, 106B215, J-003507, I14-15328, (2S)-2-(tert-butoxycarbonylamino)-4-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid, (2S)-2-(tert-butoxycarbonylamino)-4-(9H-fluoren-9-ylmethoxycarbonylamino)butyric acid, N-alpha-t-Butyloxycarbonyl-N-beta-9-Fluorenylmethyloxycarbonyl-L-2,4-diaminobutyric acid, Nalpha-t-Boc-Ngamma-(9-fluorenylmethyloxycarbonyl)-(L)-2,4-diaminobutyric acid, (2S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid, (S)-2-[(tert-Butoxycarbonyl)amino]-4-[[[(9H-fluorene-9-yl)methoxy]carbonyl]amino]butanoic acid, Butanoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-, C24H28N2O6, Boc-Dab(Fmoc)-OH, 95% 250mg, CID2755945, 4-(9H-fluoren-9-ylmethoxycarbonylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic Acid,

Complexity	654
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	440.195g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	440.496g/mol
Monoisotopic Mass	440.195g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	114A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

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

Lot Number