AG000EO4

114559-25-0 | L-Alanine, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, hydrochloride (1:1)

AG000EO4

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CAS Number	114559-25-0
Catalog Number	AG000EO4(AGN-PC-0P6G5N)
Chemical Name	L-Alanine, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, hydrochloride (1:1)
IUPAC Name	methyl (2S)-2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate;hydrochloride
InChI	InChI=1S/C9H18N2O4.ClH/c1-9(2,3)15-8(13)11-5-6(10)7(12)14-4;/h6H,5,10H2,1-4H3,(H,11,13);1H/t6-;/m0./s1
InChI Key	GDJLJNFNXINTHS-RGMNGODLSA-N
MDL Number	MFCD00798684
Molecular Formula	C9H19ClN2O4
Molecular Weight	254.7112
SMILES	O=C(OC)[C@@H](N)CNC(OC(C)(C)C)=O.[H]Cl
Synonyms	114559-25-0, H-DAP(BOC)-OME HCL, (S)-Methyl 2-amino-3-((tert-butoxycarbonyl)amino)propanoate hydrochloride, H-L-Dap(Boc)-OMe*HCl, H-Dapa(Boc)-OMe.HCl, methyl (2S)-2-amino-3-[(tert-butoxycarbonyl)amino]propanoate hydrochloride, C9H19ClN2O4, MFCD05663450, N-beta-(t-Butyloxycarbonyl)-L-2,3-diaminopropionic acid methyl ester hydrochloride, GDJLJNFNXINTHS-RGMNGODLSA-N, AK-61218, PubChem20467, H-Dap(Boc)-OMe.HCl, H-Dap(Boc)-OMe . HCl, H-Dap(Boc)-O Me . HCl, SCHEMBL2681080, CTK8B3447, DTXSID70592907, ANW-42536, MFCD00798684, (S)-methyl 2-amino-3-(tert-butoxycarbonylamino)propanoate hydrochloride, AKOS015891110, KS-00000P34, DS-14431, SC-21104, H-Dap(Boc)-OMe hydrochloride, AldrichCPR, AB0110123, AX8217324, RT-013209, FT-0697343, ST24036318, Z5604, B-6478, 559H250, I01-9186, Methyl (S)-2-Amino-3-(Boc-amino)propionate Hydrochloride, Methyl 3-[(tert-butoxycarbonyl)amino]-L-alaninate hydrochloride, Methyl (2S)-amino-3-tert-butoxycarbonylaminopropionate hydrochloride, methyl(S)-2-amino-3-tert-butoxycarbonylaminopropanoate hydrochloride, (S)-Methyl 2-amino-3-((tert-butoxycarbonyl)-amino)propanoate hydrochloride, methyl (2S)-2-amino-3-[(tert-butoxycarbonyl)amino]-propanoate hydrochloride, methyl (2S)-2-amino-3-[(tert-butoxycarbonyl)amino]propionate hydrochloride, methyl (2S)-2-amino-3-tert-butoxycarbonylaminopropionate hydrochloride, methyl (S)-2-amino-3-tert-butoxycarbonylamino-propanoate hydrochloride, methyl (S)-2-amino-3-tert-butoxycarbonylaminopropanoate hydrochloride, Methyl 3-[(tert-butoxycarbonyl)amino]-L-alaninate--hydrogen chloride (1/1), (2S)-2-Amino-3-[(tert-butoxycarbonyl)amino]propionic acid methyl ester hydrochloride, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-L-alanine, methyl ester, hydrochloride, L-Alanine, 3-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, hydrochloride (1:1), 2-Chloro-3',4'-dihydroxyacetophenone, ACN-026291, (S)-Methyl2-amino-3-((tert-butoxycarbonyl)amino)propanoatehydrochloride, 363191-25-7,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	254.103g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	254.711g/mol
Monoisotopic Mass	254.103g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	90.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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