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3,3'-Dimethyl-4,4'-biphenylene diisocyanate

Catalog No: FT-0654060

CAS No: 91-97-4

Chemical Name: 3,3'-Dimethyl-4,4'-biphenylene diisocyanate
Molecular Formula: C16H12N2O2
Molecular Weight: 264.28 g/mol
InChI Key: ICLCCFKUSALICQ-UHFFFAOYSA-N
InChI: InChI=1S/C16H12N2O2/c1-11-7-13(3-5-15(11)17-9-19)14-4-6-16(18-10-20)12(2)8-14/h3-8H,1-2H3

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

Melting_Point:	70-72°C
CAS:	91-97-4
MF:	C16H12N2O2
Flash_Point:	158.8±33.2 °C
Product_Name:	4,4'-Diisocyanato-3,3'-dimethylbiphenyl
Density:	1.1±0.1 g/cm3
FW:	264.279
Bolling_Point:	384.8±42.0 °C at 760 mmHg

Refractive_Index:	1.583
Vapor_Pressure:	0.0±0.9 mmHg at 25°C
Flash_Point:	158.8±33.2 °C
LogP:	5.03
Bolling_Point:	384.8±42.0 °C at 760 mmHg
FW:	264.279
PSA:	58.86000
Computational_Chemistry:	['1. XlogP :59 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 589 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :384 ', '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:	70-72°C
MF:	C16H12N2O2
Exact_Mass:	264.089874
Molecular_Structure:	['1 . Molar refractive index 7862 ', '2 . Molar volume 2354 ', '3 . Parachor （902K）5983 ', '4 . Surface tension 417 ', '5 . Polarizability 3117']
Density:	1.1±0.1 g/cm3
More_Info:	['1 . Appearance 常温下为White 固状颗粒 ', '2 . Density（g/mL,25/4℃） 1197 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）70-72 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC, 0667kpa）195-197 ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）218 ', '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。']