AG0030NJ

3060-46-6 | L-Leucine, N-methyl-

AG0030NJ

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CAS Number	3060-46-6
Catalog Number	AG0030NJ(AGN-PC-0WAENP)
Chemical Name	L-Leucine, N-methyl-
IUPAC Name	(2S)-4-methyl-2-(methylamino)pentanoic acid
InChI	InChI=1S/C7H15NO2/c1-5(2)4-6(8-3)7(9)10/h5-6,8H,4H2,1-3H3,(H,9,10)/t6-/m0/s1
InChI Key	XJODGRWDFZVTKW-LURJTMIESA-N
MDL Number	MFCD00065919
Molecular Formula	C7H15NO2
Molecular Weight	145.1995
SMILES	CC(C)C[C@H](NC)C(O)=O
UNII	2YT9687ECD
Synonyms	N-Methyl-L-leucine, 3060-46-6, (S)-4-Methyl-2-(methylamino)pentanoic acid, N-Methylleucine, N-Me-Leu-OH, L-Leucine, N-methyl-, MeLeu, methyl-L-leucine, UNII-2YT9687ECD, 2YT9687ECD, H-ALPHA-METHYL-L-LEUCINE, N-methyl-l-leu, AK107655, Leucine, N-methyl-, AC1MCSAQ, SCHEMBL93452, AMGLY00163, CTK1A1168, XJODGRWDFZVTKW-LURJTMIESA-N, ZINC160405, KS-00000J9G, ANW-74881, FCH835634, MFCD00065919, AKOS006282756, ACM3060466, CS-W008140, AC-24158, AJ-15591, AS-19192, SC-82208, AX8020112, DB-038132, TC-163626, FT-0695191, ST24036190, X5243, (2S)-4-methyl-2-(methylamino)pentanoic acid, 060M466, UNII-JDA2WC7NY8 component XJODGRWDFZVTKW-LURJTMIESA-N, DL-N-Methylleucine, Z-N-methyl-L-leucine, D0F6OK, C7H15NO2, ACN-026321, CID2777993, 2566-33-8, MLE, 105743-53-1, 33099-08-0, 4125-95-5, 66866-69-1,

Complexity	112
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	145.11g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	145.202g/mol
Monoisotopic Mass	145.11g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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