Molecular Formula: 182.17
Formula Weight: C9H10O4
Inchl Key: DZAUWHJDUNRCTF-UHFFFAOYSA-N
Inchl: InChI=1S/C9H10O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5,10-11H,2,4H2,(H,12,13)

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

Bolling_Point:	417.5±30.0 °C at 760 mmHg
CAS:	1078-61-1
MF:	C9H10O4
Melting_Point:	136-139 °C(lit.)
Symbol:	Warning
Density:	1.4±0.1 g/cm3
FW:	182.173
Product_Name:	Hydrocaffeate
Flash_Point:	220.4±21.1 °C

Bolling_Point:	417.5±30.0 °C at 760 mmHg
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
LogP:	0.50
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/cm3,25℃）1398 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）136-139 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,11mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC,25mm）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）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']
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :53 ', '6. TPSA 778 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :181 ', '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:	136-139 °C(lit.)
Exact_Mass:	182.057907
MF:	C9H10O4
Density:	1.4±0.1 g/cm3
Refractive_Index:	1.620
PSA:	77.76000
Flash_Point:	220.4±21.1 °C
Molecular_Structure:	['1. Molar refractive index 4576 ', '2. Molar volume 1302 ', '3. Parachor （902K）3754 ', '4. Surface tension 69 ', '5. Dielectric constant N/A ', '6. Polarizability 1814 ', '7. Single isotope mass 182057909 Da ', '8. Nominal mass 182 Da ', '9. Average mass 1821733 Da']
FW:	182.173

WGK_Germany:	3
Symbol:	Warning
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	S26-S36
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RTECS:	MW5143500
RIDADR:	NONH for all modes of transport
Risk_Statements(EU):	R36/37/38
Hazard_Codes:	Xi: Irritant;