3-(2-Guanidino-thiazol-4-yl-methylthio)-propionitrile

Catalog No: FT-0641616

CAS No: 76823-93-3

Chemical Name: 3-(2-Guanidino-thiazol-4-yl-methylthio)-propionitrile
Molecular Formula: C8H11N5S2
Molecular Weight: 241.3 g/mol
InChI Key: FSKYYRZENXOYAP-UHFFFAOYSA-N
InChI: InChI=1S/C8H11N5S2/c9-2-1-3-14-4-6-5-15-8(12-6)13-7(10)11/h5H,1,3-4H2,(H4,10,11,12,13)

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:	Warning
FW:	241.33600
Density:	1.49g/cm3
CAS:	76823-93-3
Bolling_Point:	452.4ºC at 760 mmHg
Product_Name:	3-[[[2-[(Diaminomethylene]amino-4-thiazolyl]thio]propionitrile
Melting_Point:	128-132 °C(lit.)
Flash_Point:	227.4ºC
MF:	C8H11N5S2

Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 6433 ', '2 . Molar volume （m3/mol）1616 ', '3 . Parachor （902K）4684 ', '4 . Surface tension 704 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 2550']
LogP:	2.59548
Flash_Point:	227.4ºC
Refractive_Index:	1.727
FW:	241.33600
Density:	1.49g/cm3
Bolling_Point:	452.4ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :3 ', '6. TPSA 155 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :268 ', '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:	128-132 °C(lit.)
PSA:	154.62000
Exact_Mass:	241.04600
MF:	C8H11N5S2

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard_Codes:	Xn: Harmful;
Risk_Statements(EU):	R22
Safety_Statements:	S22-S24-S37
Symbol:	Warning
Warning_Statement:	P280
RIDADR:	NONH for all modes of transport
HS_Code:	2934100090
WGK_Germany:	1