Molecular Formula: 235.19
Formula Weight: C11H9NO5
Inchl Key: JHCYWIFFIHXGAG-UHFFFAOYSA-N
Inchl: InChI=1S/C11H9NO5/c1-16-10(14)7-3-8(11(15)17-2)5-9(4-7)12-6-13/h3-5H,1-2H3

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

Symbol:	Warning
FW:	235.19300
Density:	1.24g/cm3
CAS:	46828-05-1
Bolling_Point:	350.3ºC at 760 mmHg
Product_Name:	dimethyl 5-isocyanatobenzene-1,3-dicarboxylate
Melting_Point:	106-109ºC(lit.)
Flash_Point:	164.1ºC
MF:	C11H9NO5

Molecular_Structure:	['1 . Molar refractive index 5870 ', '2 . Molar volume 1890 ', '3 . Parachor （902K）4843 ', '4 . Surface tension 430 ', '5 . Polarizability 2327 ', '6 . Dielectric constant 未确定']
Flash_Point:	164.1ºC
Refractive_Index:	1.533
FW:	235.19300
Density:	1.24g/cm3
Bolling_Point:	350.3ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 82 ', '7. Heavy Atom Count :17 ', '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']
LogP:	1.22710
Melting_Point:	106-109ºC(lit.)
PSA:	82.03000
MF:	C11H9NO5
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）106-109 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Exact_Mass:	235.04800

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Hazard_Codes:	Xn
Risk_Statements(EU):	R20/22;R36/37/38;R42
Safety_Statements:	S22-S26-S36/37/39-S45
Symbol:	Warning
Warning_Statement:	P261-P280-P305 + P351 + P338
RIDADR:	UN 3335
HS_Code:	2929109000