AG00G4EV

857478-30-9 | N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-isovaline

AG00G4EV

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CAS Number	857478-30-9
Catalog Number	AG00G4EV(AGN-PC-0OK20Q)
Chemical Name	N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-isovaline
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylbutanoic acid
InChI	InChI=1S/C20H21NO4/c1-3-20(2,18(22)23)21-19(24)25-12-17-15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11,17H,3,12H2,1-2H3,(H,21,24)(H,22,23)/t20-/m0/s1
InChI Key	DZSLHAJXIQCMLR-FQEVSTJZSA-N
MDL Number	MFCD12031688
Molecular Formula	C20H21NO4
Molecular Weight	339.3850
SMILES	C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@@](CC)(C)C(=O)O
Synonyms	857478-30-9, Fmoc-IsoVal-OH, (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methylbutanoic acid, Fmoc-L-isovaline, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-isovaline, AK163819, Fmoc--D-isovaline, (S)-N-Fmoc-a-ethylalanine, SCHEMBL6881610, DZSLHAJXIQCMLR-FQEVSTJZSA-N, KS-00000SP9, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-butanoic Acid, MFCD12031688, ZINC35813219, AKOS024465032, ACN-040859, DS-8338, FCH2844654, Fmoc-(S)-2-amino-2-methylbutanoic acid, AX8294929, CS-0084320, 478F309, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-isovaline, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-butyric acid, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methylbutanoic acid, (S)-2-(9H-Fluorene-9-ylmethoxycarbonylamino)-2-methylbutanoic acid, (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-2-methylbutanoic acid, (S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-2-methylbutanoic acid, (S)-N-alpha-(9-Fluorenylmethyloxycarbonyl)-alpha-ethylalanine (>98%, >98%ee), CID11559159, N/A,

Complexity	486
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	339.147g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	339.391g/mol
Monoisotopic Mass	339.147g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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