8-((4-bromo-2,3-dioxobutyryl)thio)adenosine 5'diphosphate

Modify Date: 2024-04-08 09:33:28

8-((4-bromo-2,3-dioxobutyryl)thio)adenosine 5'diphosphate Structure
8-((4-bromo-2,3-dioxobutyryl)thio)adenosine 5'diphosphate structure
Common Name 8-((4-bromo-2,3-dioxobutyryl)thio)adenosine 5'diphosphate
CAS Number 115678-78-9 Molecular Weight 622.235
Density 2.4±0.1 g/cm3 Boiling Point 929.7±75.0 °C at 760 mmHg
Molecular Formula C14H18BrN5O12P2S Melting Point N/A
MSDS N/A Flash Point 516.1±37.1 °C

 Names

Name 8-[(4-Bromo-2,3-dioxobutyl)sulfanyl]adenosine 5'-(trihydrogen diphosphate)
Synonym More Synonyms

 Chemical & Physical Properties

Density 2.4±0.1 g/cm3
Boiling Point 929.7±75.0 °C at 760 mmHg
Molecular Formula C14H18BrN5O12P2S
Molecular Weight 622.235
Flash Point 516.1±37.1 °C
Exact Mass 620.933105
LogP -3.71
Vapour Pressure 0.0±0.3 mmHg at 25°C
Index of Refraction 1.857
InChIKey XCWZPSOJYVIEHY-QYVSTXNMSA-N
SMILES Nc1ncnc2c1nc(SCC(=O)C(=O)CBr)n2C1OC(COP(=O)(O)OP(=O)(O)O)C(O)C1O

 Synonyms

Adenosine, 8-[(4-bromo-2,3-dioxobutyl)thio]-, 5'-(trihydrogen diphosphate)
8-[(4-Bromo-2,3-dioxobutyl)sulfanyl]adenosine 5'-(trihydrogen diphosphate)
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