2,2'-Dichloro bisphenol a mono-D-glucuronide-d12

cas: 2673270-16-9 — see every product listed under this CAS number, including other names

2,2'-Dichloro bisphenol a mono-D-glucuronide-d12 (CAS 2673270-16-9) is a chemical reagent available from Chemat. Available pack sizes: 1 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-150985S-1 mg
cas2673270-16-9
size1 mg
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Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[2-chloro-4-[2-(3-chloro-2,5,6-trideuterio-4-hydroxyphenyl)-1,1,1,3,3,3-hexadeuteriopropan-2-yl]-3,5,6-trideuteriophenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 2673270-16-9) is a chemical compound with the molecular formula C21H22Cl2O8 and a molecular weight of 485.4 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[2-chloro-4-[2-(3-chloro-2,5,6-trideuterio-4-hydroxyphenyl)-1,1,1,3,3,3-hexadeuteriopropan-2-yl]-3,5,6-trideuteriophenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: XKQOXHHNPIOVMM-ODRNHMGGSA-N.

Identity
Molecular formulaC21H22Cl2O8
Molecular weight485.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[2-chloro-4-[2-(3-chloro-2,5,6-trideuterio-4-hydroxyphenyl)-1,1,1,3,3,3-hexadeuteriopropan-2-yl]-3,5,6-trideuteriophenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyXKQOXHHNPIOVMM-ODRNHMGGSA-N
SMILES[2H]C1=C(C(=C(C(=C1C(C2=C(C(=C(C(=C2[2H])[2H])O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O)Cl)[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])[2H])Cl)O)[2H]

Computed by PubChem (NCBI)

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