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Dethiobiotin
[CAS# 533-48-2]

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Identification
Name Dethiobiotin
Synonyms 6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoic acid
Molecular Structure CAS # 533-48-2, Dethiobiotin, 6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanoic acid
Molecular Formula C10H18N2O3
Molecular Weight 214.26
CAS Registry Number 533-48-2
EC Number 208-566-2
SMILES C[C@H]1[C@H](NC(=O)N1)CCCCCC(=O)O
Properties
Solubility 2764 mg/L (25 ºC water)
Density 1.1±0.1 g/cm3, Calc.*
Index of Refraction 1.473, Calc.*
Melting point 159.86 ºC
Boiling Point 393.08 ºC, 476.4±18.0 ºC (760 mmHg), Calc.*
Flash Point 241.9±21.2 ºC, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
Safety Data
Hazard Symbols symbol   GHS07 Warning    Details
Hazard Statements H302-H312-H332    Details
Precautionary Statements P261-P264-P270-P271-P280-P301+P317-P302+P352-P304+P340-P317-P321-P330-P362+P364-P501    Details
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