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Caffeine-(trimethyl-d9)

ALDRICH/725625 - 99 atom % D, 98% (CP)

Synonym: 1,3,7-Trimethyl-d9-xanthine

Empirical Formula (Hill Notation): C8D9HN4O2
Molecular Weight: 203.25
MDL Number: MFCD06658615
Linear Formula: C8D9HN4O2
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-725625-100MG 100 mg
 $411.00
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assay 98% (CP)
form powder
InChI 1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3/i1D3,2D3,3D3
InChI key RYYVLZVUVIJVGH-GQALSZNTSA-N
isotopic purity 99 atom % D
mass shift M+9
mp 234-236.5 °C (lit.)
Quality Level 200 
SMILES string O=C(N(C([2H])([2H])[2H])C1=O)N(C2=C1N(C([2H])([2H])[2H])C=N2)C([2H])([2H])[2H]
technique(s) mass spectrometry (MS): suitable
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 .
Symbol GHS07  GHS07
Signal word Warning
Hazard statements H302
Precautionary statements P301 + P312 + P330
Hazard Codes Xn
Risk Statements 22
RIDADR NONH for all modes of transport
Flash Point(F) Not applicable
Flash Point(C) Not applicable
Purity 98% (CP)
mp 234-236.5 °C (lit.)
UNSPSC 12352114

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