AG002JR5

208522-10-5 | L-Norleucine, N-[(1,1-dimethylethoxy)carbonyl]-5-methyl-

AG002JR5

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CAS Number	208522-10-5
Catalog Number	AG002JR5(AGN-PC-0WCYJG)
Chemical Name	L-Norleucine, N-[(1,1-dimethylethoxy)carbonyl]-5-methyl-
IUPAC Name	(2S)-5-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
InChI	InChI=1S/C12H23NO4/c1-8(2)6-7-9(10(14)15)13-11(16)17-12(3,4)5/h8-9H,6-7H2,1-5H3,(H,13,16)(H,14,15)/t9-/m0/s1
InChI Key	PMBPWNBVQINJRH-VIFPVBQESA-N
MDL Number	MFCD00273432
Molecular Formula	C12H23NO4
Molecular Weight	245.3153
SMILES	CC(C)CC[C@H](NC(OC(C)(C)C)=O)C(O)=O
Synonyms	208522-10-5, (S)-2-((tert-Butoxycarbonyl)amino)-5-methylhexanoic acid, SCHEMBL6508453, KS-00000L9S, ZINC70414959, (S)-2-(tert-butoxycarbonylamino)-5-methylhexanoic acid, L-Norleucine, N-[(1,1-dimethylethoxy)carbonyl]-5-methyl-, Boc-(S)-2-amino-5-methylhexanoic acid, (R)-2-((tert-Butoxycarbonyl)amino)-5-methylhexanoic acid, N/A,

Complexity	268
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	2
Isotope Atom Count	0
Molecular Weight	245.319g/mol
Monoisotopic Mass	245.163g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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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