AG0039BP

56545-22-3 | Methyl L-homoalaninate HCl

AG0039BP

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CAS Number	56545-22-3
Catalog Number	AG0039BP(AGN-PC-0OCE7Y)
Chemical Name	Methyl L-homoalaninate HCl
IUPAC Name	methyl (2S)-2-aminobutanoate;hydrochloride
InChI	InChI=1S/C5H11NO2.ClH/c1-3-4(6)5(7)8-2;/h4H,3,6H2,1-2H3;1H/t4-;/m0./s1
InChI Key	AHAQQEGUPULIOZ-WCCKRBBISA-N
MDL Number	MFCD09037399
Molecular Formula	C5H12ClNO2
Molecular Weight	153.6073
SMILES	Cl.N[C@H](C(=O)OC)CC
Synonyms	56545-22-3, (S)-Methyl 2-aminobutanoate hydrochloride, H-ABU-OME HCL, methyl (S)-2-aminobutanoate hydrochloride, methyl (2S)-2-aminobutanoate hydrochloride, L-2-Aminobutyric Acid Methyl Ester Hydrochloride, methyl (s)-2-aminobutyrate hydrochloride, H-Abu-OMe . HCl, Methyl L-homoalaninate HCl, SCHEMBL1064128, KS-00000LGM, DTXSID40746990, AHAQQEGUPULIOZ-WCCKRBBISA-N, MFCD09037399, AKOS027250613, methyl (s)-aminobutyrate hydrochloride, MethylL-2-aminobutanoate hydrochloride, methyl (S)-aminobutanoate hydrochloride, DS-12386, SC-91370, CS-0031391, FT-0661633, L-|A-Aminobutyric Acid Methyl Ester Hydrochloride, (S)-2-Aminobutanoic Acid Methyl Ester Hydrochloride, (S)-2-Amino-butanoic Acid Methyl Ester Hydrochloride, Methyl (2S)-2-aminobutanoate--hydrogen chloride (1/1), Butanoic acid, 2-amino-, methyl ester, hydrochloride, (2S)-, (2S)-Butanoic acid, 2-amino-, methyl ester, hydrochloride (1:1), Methyl (S)-2-aminobutanoate HCl, 15399-22-1,

Complexity	82.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	153.056g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	153.606g/mol
Monoisotopic Mass	153.056g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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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