FT-0612765 CAS:872-35-5 chemical structure

2-MERCAPTOIMIDAZOLE

Catalog No: FT-0612765

CAS No: 872-35-5

Molecular Formula: 100.14
Formula Weight: C3H4N2S
Inchl Key: OXFSTTJBVAAALW-UHFFFAOYSA-N
Inchl: InChI=1S/C3H4N2S/c6-3-4-1-2-5-3/h1-2H,(H2,4,5,6)

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:	228-231 °C(lit.)
CAS:	872-35-5
MF:	C3H4N2S
Flash_Point:	108.0±22.6 °C
Product_Name:	2-MERCAPTOIMIDAZOLE
Density:	1.4±0.1 g/cm3
FW:	100.142
Bolling_Point:	255.0±23.0 °C at 760 mmHg

Refractive_Index:	1.653
Vapor_Pressure:	0.0±0.5 mmHg at 25°C
Flash_Point:	108.0±22.6 °C
LogP:	0.83
Bolling_Point:	255.0±23.0 °C at 760 mmHg
PSA:	67.48000
Molecular_Structure:	['1 . Molar refractive index 2695 ', '2 . Molar volume （m3/mol）735 ', '3 . Parachor （902K）2095 ', '4 . Surface tension 657 ', '5 . Polarizability （10 -24cm 3）1068']
Computational_Chemistry:	['1. XlogP :-03 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 562 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :87 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	228-231 °C(lit.)
MF:	C3H4N2S
Exact_Mass:	100.009521
FW:	100.142
Density:	1.4±0.1 g/cm3
More_Info:	['1 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '2 . Melting point（ºC）228-231°C ', '3 . Boiling point（ºC,Atmospheric pressure）Unknow ', '4 . Boiling point（ºC,52kPa）Unknow ', '5 . Refractive indexUnknow ', '6 . Flash point（ºC）Unknow ', '7 . Specific rotation（º）Unknow ', '8 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '9 . Vapor pressure（kPa,25ºC）Unknow ', '10 . Saturated vapor pressure（kPa,60ºC）Unknow ', '11 . Combustion heat（KJ/mol）Unknow ', '12 . Critical temperature（ºC）Unknow ', '13 . Critical pressure（KPa）Unknow ', '14 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '15 . Upper limit of explosion（%,V/V）Unknow ', '16 . Lower limit of explosion（%,V/V）Unknow ', '17 . Solubility Insoluble in 乙酸乙酯汽油四氯化碳甲苯，微Soluble in 丙酮，Soluble in Water 甲醇and Ethanol ', '18 . Appearance Colourless Solid ', '19 . Density（g/mL,25/4℃）Unknow']