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1-n-Hexyltheobromine, 98+%

Product Code. 11353167
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Product Code. 11353167 Supplier Thermo Scientific Alfa Aesar Supplier No. L13597.MD
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Estimated Shipment: 01-10-2026
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CAS: 1028-33-7 | C13H20N4O2 | 264.33 g/mol

A vasodilator

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

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Specifications

CAS 1028-33-7
Melting Point 80°C to 81°C
Molecular Formula C13H20N4O2
MDL Number MFCD00041424
Quantity 250 mg
Beilstein 270632
Merck Index 14,7127
Synonym pentifylline, 1-hexyltheobromine, 1-n-hexyltheobromine, hexyltheobromine, cosaldon, pentifyllin, cosadon, theobromine, 1-hexyl, sk 7 pharmaceutical, 1-hexyl-3,7-dimethylxanthine
InChI Key MRWQRJMESRRJJB-UHFFFAOYSA-N
SMILES CCCCCCN1C(=O)N(C)C2=C(N(C)C=N2)C1=O
IUPAC Name 1-hexyl-3,7-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Molecular Weight (g/mol) 264.33
PubChem CID 70569
Formula Weight 264.33
Percent Purity ≥98%
Chemical Name or Material 1-n-Hexyltheobromine
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