| CAS Number | 41036-19-5 |
| Catalog Number | AG00C66T(AGN-PC-0RPSPI) |
| Chemical Name | H-ALA-ALA-OME HCL |
| IUPAC Name | methyl (2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoate;hydrochloride |
| InChI | InChI=1S/C7H14N2O3.ClH/c1-4(8)6(10)9-5(2)7(11)12-3;/h4-5H,8H2,1-3H3,(H,9,10);1H/t4-,5-;/m0./s1 |
| InChI Key | WVSVBOMWSCRPGM-FHAQVOQBSA-N |
| MDL Number | MFCD00237711 |
| Molecular Formula | C7H15ClN2O3 |
| Molecular Weight | 210.6586 |
| SMILES | C[C@H](NC([C@@H](N)C)=O)C(OC)=O.[H]Cl |
| Synonyms | 41036-19-5,
(S)-Methyl 2-((S)-2-aminopropanamido)propanoate hydrochloride,
H-ALA-ALA-OME HCL,
H-Ala-Ala-OMe.HCl,
methyl (2S)-2-[(2S)-2-aminopropanamido]propanoate hydrochloride,
methyl (L)-alanyl-(L)-alaninate hydrochloride,
H-Ala-Ala-OMe . HCl,
C7H14N2O3.HCl,
SCHEMBL3883130,
DTXSID00553440,
4448AH,
MFCD00237711,
ST24036303,
K-8707,
Methyl L-alanyl-L-alaninate--hydrogen chloride (1/1),
H-Ala-Ala-Ome.Hydrochloride,
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| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.658g/mol |
| Monoisotopic Mass | 210.077g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 81.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
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UN Code
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Certificate of Analysis
Lot Number