809675

Deoxycholic-2,2,4,4,11,11-d₆ acid

≥98 atom % D, ≥98% (CP)

• Empirical Formula (Hill Notation): C₂₄D₆H₃₄O₄
• Molecular Weight: 398.61
• UNSPSC Code: 12352106
• PubChem Substance ID: 329769177
• NACRES: NA.12

Properties

• isotopic purity: ≥98 atom % D
• Quality Level: 200
• Assay: ≥98% (CP)
• form: powder
• technique(s): mass spectrometry (MS): suitable
• mass shift: M+6
• storage temp.: −20°C
• SMILES string: [2H]C1([2H])[C@@H](O)C([2H])([2H])C(CCC2C3C([2H])([2H])[C@H](O)[C@@]4(C)C2CC[C@H]4[C@@H](CCC(O)=O)C)[C@]3(C)C1
• InChI: 1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15?,16-,17?,18?,19?,20?,21+,23+,24-/m1/s1/i10D2,12D2,13D2
• InChI key: KXGVEGMKQFWNSR-UEKQVLGMSA-N

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Statements: H302,H315,H319,H335
• Precautionary Statements: P261 - P264 - P270 - P301 + P312 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable