3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE

Catalog No: FT-0639611

CAS No: 40127-89-7

Chemical Name: 3-AMINO-6-(CHLOROMETHYL)-2-PYRAZINECARBONITRILE 4-OXIDE
Molecular Formula: C6H5ClN4O
Molecular Weight: 184.58
InChI Key: WFVMXQJFTZCDPJ-UHFFFAOYSA-N
InChI: InChI=1S/C6H5ClN4O/c7-1-4-3-11(12)6(9)5(2-8)10-4/h3,9,12H,1H2

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Symbol:	GHS07
CAS:	40127-89-7
Flash_Point:	313.297ºC
Product_Name:	6-(chloromethyl)-4-hydroxy-3-iminopyrazine-2-carbonitrile
Bolling_Point:	594.424ºC at 760 mmHg
FW:	184.58300
Melting_Point:	144-146 °C(lit.)
MF:	C6H5ClN4O
Density:	1.588g/cm3

Refractive_Index:	1.68
Flash_Point:	313.297ºC
LogP:	1.28398
Bolling_Point:	594.424ºC at 760 mmHg
FW:	184.58300
PSA:	88.16000
Computational_Chemistry:	['1. XlogP :-04 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 835 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :324 ', '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:	144-146 °C(lit.)
MF:	C6H5ClN4O
Exact_Mass:	184.01500
Density:	1.588g/cm3
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1） Unknow ', '4 . Melting point（ºC）144-146 ', '5 . Boiling point（ºC）Unknow ', '6 . Boiling point（ºC，2mm hg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC） Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']

Symbol:	GHS07
Risk_Statements(EU):	20/21/22-36/37/38
HS_Code:	2933990090
WGK_Germany:	3
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xn
Warning_Statement:	P261-P280-P305 + P351 + P338
Safety_Statements:	H302 + H312 + H332-H315-H319-H335