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614122

Sigma-Aldrich

Chenodeoxycholic acid-2,2,4,4-d4

98 atom % D, 98% (CP)

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Empirical Formula (Hill Notation):
C24D4H36O4
Molecular Weight:
396.60
MDL number:
PubChem Substance ID:
NACRES:
NA.12

isotopic purity

98 atom % D

assay

98% (CP)

technique(s)

mass spectrometry (MS): suitable

mp

165-167 °C (lit.)

mass shift

M+4

SMILES string

[2H]C1([2H])C[C@]2(C)[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3[C@H](O)C[C@@H]2C([2H])([2H])[C@@H]1O)[C@H](C)CCC(O)=O

InChI

1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1/i8D2,12D2

InChI key

RUDATBOHQWOJDD-PSTGXAJBSA-N

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This Item
910686901682614149
vibrant-m

614122

Chenodeoxycholic acid-2,2,4,4-d4

vibrant-m

901682

Glycolithocholic acid-2,2,4,4-d4

vibrant-m

614149

Cholic acid-2,2,4,4-d4

isotopic purity

98 atom % D

isotopic purity

≥98 atom % D

isotopic purity

≥98 atom % D

isotopic purity

98 atom % D

technique(s)

mass spectrometry (MS): suitable

technique(s)

mass spectrometry (MS): suitable

technique(s)

mass spectrometry (MS): suitable

technique(s)

mass spectrometry (MS): suitable

assay

98% (CP)

assay

≥98% (CP)

assay

≥98% (CP)

assay

98% (CP)

mass shift

M+4

mass shift

M+4

mass shift

M+4

mass shift

M+4

mp

165-167 °C (lit.)

mp

-

mp

-

mp

200-201 °C (lit.)

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable


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