3-hydroxymandelic Acid
3_hydroxymandelic_acid synonyms
alpha,3-Dihydroxybenzeneacetic acid; 3-Hydroxymandelic acid; Hydroxy(3-hydroxyphenyl)acetic acid; 3-Hydroxyphenylglycolic acid; dl-Hydroxy(m-hydroxyphenyl)acetic acid
Graphical representations:
View large 3D structure
Molecular Formula: C8H8O4
Natural Isotopic Abundance Mass: 168.14672
Mono-Isotopic Molecular Masses:
- C12N14: 168.0422587452
- C13N14: 176.0690974476
- C12N15: 168.0422587452
- C13N15: 176.0690974476
InChI string: InChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m1/s1
PubChem Compound (CID): 86957CAS Registry number: 17119-15-2
Sigma-Aldrich: 55520_FLUKA
ChemIDplus: 017119152
EINECS: 241-182-3
ChemDB: 6046659
NIST: 3320276251
MMCD: cq_10776
MDL: MFCD00042723
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)