AG00I9J2

53363-89-6 | L-Leucine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-

AG00I9J2

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CAS Number	53363-89-6
Catalog Number	AG00I9J2(AGN-PC-0OBV8Q)
Chemical Name	L-Leucine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-
IUPAC Name	(2S)-4-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pentanoic acid
InChI	InChI=1S/C12H23NO4/c1-8(2)7-9(10(14)15)13(6)11(16)17-12(3,4)5/h8-9H,7H2,1-6H3,(H,14,15)/t9-/m0/s1
InChI Key	YXJFAOXATCRIKU-VIFPVBQESA-N
MDL Number	MFCD00038522
Molecular Formula	C12H23NO4
Molecular Weight	245.3153
SMILES	CC(C)C[C@H](N(C(OC(C)(C)C)=O)C)C(O)=O
Synonyms	53363-89-6, Boc-N-methyl-L-leucine, Boc-N-Me-Leu-OH, L-Leucine, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-, N-alpha-t-Butyloxycarbonyl-N-alpha-methyl-L-leucine, (S)-2-((tert-Butoxycarbonyl)(methyl)amino)-4-methylpentanoic acid, N-(tert-butoxycarbonyl)-N-methyl-L-leucine, N-boc-N-methyl-d-leucine, (S)-2-(tert-butoxycarbonyl(methyl)amino)-4-methylpentanoic acid, (2S)-2-{[(tert-butoxy)carbonyl](methyl)amino}-4-methylpentanoic acid, Boc-MeLeu-OH, BocMeLeuOH, N-Boc-N-methylleucine, N-Methyl-N-Boc-L-Leucine, Boc-Nalpha-methyl-L-leucine, SCHEMBL38056, AC1Q1O98, TMA024, CTK6A4241, YXJFAOXATCRIKU-VIFPVBQESA-N, t-butoxycarbonyl-N-methyl-L-leucine, ZINC2391034, ANW-31717, MFCD00038522, AKOS015836698, AKOS015908789, N-methyl-tert-butoxycarbonyl-L-leucine, t-Butyloxycarbonyl-N-Methyl-L-Leucine, KS-0000190Z, N-tert-Butoxycarbonyl-N-methyl-L-leucine, AJ-35709, DS-14206, N-Alpha-T-Boc-N-Alpha-Methyl-L-Leucine, SC-70379, TC-120462, FT-0629966, ST24035840, K-9681, 777B825, A829541, I14-3510, Boc-N-Me-Leu-OH, >=99.0% (sum of enantiomers, TLC), (2S)-2-[(tert-butoxycarbonyl)(methyl)amino]-4-methylpentanoic acid, 2-((TERT-BUTOXYCARBONYL)(METHYL)AMINO)-4-METHYLPENTANOIC ACID, (2S)-4-methyl-2-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid, (2S)-4-methyl-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pentanoic acid, C12H23NO4, NSC334323, ACN-033345, CID7010555, 79777-82-5, 89536-84-5, Boc-N-methylleucine; N-tert-Butoxycarbonyl-N-methyl-L-leucine; N-tert-Butoxycarbonyl-N-methylleucine,

Complexity	281
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	245.163g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	245.319g/mol
Monoisotopic Mass	245.163g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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