AG007NP9

22818-43-5 | (S)-3-Amino-5-methylhexanoic acid

AG007NP9

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CAS Number	22818-43-5
Catalog Number	AG007NP9(AGN-PC-0O81VG)
Chemical Name	(S)-3-Amino-5-methylhexanoic acid
IUPAC Name	(3S)-3-amino-5-methylhexanoic acid
InChI	InChI=1S/C7H15NO2/c1-5(2)3-6(8)4-7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t6-/m0/s1
InChI Key	MLYMSIKVLAPCAK-LURJTMIESA-N
MDL Number	MFCD01076258
Molecular Formula	C7H15NO2
Molecular Weight	145.1995
SMILES	CC(C)C[C@H](N)CC(O)=O
Synonyms	22818-43-5, (S)-3-Amino-5-methyl-hexanoic acid, (S)-3-amino-5-methylhexanoic acid, l-beta-homoleucine, (3S)-3-amino-5-methylhexanoic acid, (3s)-3-amino-5-methyl-hexanoic acid, beta-homoleucine, AK-44602, h-leu-(c*ch2)oh, (S)-beta-3-homoleucine, AC1MC55D, SCHEMBL288273, CTK8C4535, KS-00000KGE, DTXSID70375813, ZINC170350, ACT04898, ANW-72291, FCH835701, MFCD01076258, AKOS006282080, AC-6714, (3S)-3-azanyl-5-methyl-hexanoic acid, AJ-17473, DS-13377, SC-26176, AB0030985, AX8032740, TC-161036, CS-0036492, FT-0630327, X3295, X-2905, I04-1178, J-800385, Methionyl butyrate, L-HOMOLEUCINE, C7H15NO2, 3-amino-5-methyl-hexanoic Acid, (S)-3-Amino-5-methylhexanoicacid, (S)-3-Amino-5-methyl-hexanoicacid, CID2761525, 96386-92-4,

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	63.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.7

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