Citiolone

Catalog No: FT-0637623

CAS No: 17896-21-8

Molecular Formula: 159.21
Formula Weight: C6H9NO2S
Inchl Key: NRFJZTXWLKPZAV-UHFFFAOYSA-N
Inchl: InChI=1S/C6H9NO2S/c1-4(8)7-5-2-3-10-6(5)9/h5H,2-3H2,1H3,(H,7,8)

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	109-111 °C
CAS:	17896-21-8
MF:	C6H9NO2S
Flash_Point:	212.2±25.7 °C
Product_Name:	Acetylhomocysteine thiolactone
Density:	1.3±0.1 g/cm3
FW:	159.206
Bolling_Point:	427.3±34.0 °C at 760 mmHg

Refractive_Index:	1.542
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Flash_Point:	212.2±25.7 °C
LogP:	-0.80
Bolling_Point:	427.3±34.0 °C at 760 mmHg
PSA:	71.47000
Molecular_Structure:	['1 . Molar refractive index 3965 ', '2 . Molar volume 1260 ', '3 . Parachor （902K）3296 ', '4 . Surface tension 467 ', '5 . Polarizability 1572']
Computational_Chemistry:	['1 . XlogP -03 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count 4 ', '6 . TPSA 462 ', '7 . Heavy Atom Count 10 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 169 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 1 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
Melting_Point:	109-111 °C
MF:	C6H9NO2S
Exact_Mass:	159.035400
FW:	159.206
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance White 粉末 ', '2 . Density（g/mL,25/4℃）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）109-111 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC, 52kPa）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºC）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 在Water 中易溶，在 Ethanol 丙酮氯仿中不溶。']