Catalog Number |
ACM201740887 |
CAS |
201740-88-7 |
Synonyms |
L-Histidine-13C6 hydrochloride monohydrate |
IUPAC Name |
(2S)-2-amino-3-((2,4,5-13C3)1H-imidazol-5-yl)(1,2,3-13C3)propanoic acid;hydrate;hydrochloride |
Molecular Weight |
215.59 |
Molecular Formula |
13C6H12N3O3Cl |
Canonical SMILES |
[13CH]1=[13C](N[13CH]=N1)[13CH2][13C@@H]([13C](=O)O)N.O.Cl |
InChI |
InChI=1S/C6H9N3O2.ClH.H2O/c7-5(6(10)11)1-4-2-8-3-9-4;;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1H;1H2/t5-;;/m0../s1/i1+1,2+1,3+1,4+1,5+1,6+1;; |
InChI Key |
CMXXUDSWGMGYLZ-NHMLGGAVSA-N |
Melting Point |
254 °C (489 °F) (dec.) |
Purity |
98% |
Appearance |
White crystalline |
Isotopic Enrichment |
97-99 atom % 13C |
pH |
3-4 at 105 g/L at 25 °C (77 °F) |
Unlabeled CAS |
5934-29-2 |
Unlabeled Synonyms |
L-α-Amino-β-(4-imidazolyl)propionic acidmonohydrochloride |