Molecular Formula: 174.20
Formula Weight: C11H10O2
Inchl Key: NGSZDVVHIGAMOJ-YHYXMXQVSA-N
Inchl: InChI=1S/C11H10O2/c1-2-5-10-8-6-3-4-7-9(8)11(12)13-10/h3-7H,2H2,1H3/b10-5-

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:	174.19600
Density:	1.122 g/mL at 25 °C(lit.)
CAS:	17369-59-4
Bolling_Point:	170 °C12 mm Hg(lit.)
Product_Name:	3-Propylidenephthalide
Melting_Point:	5 °C(lit.)
Flash_Point:	>230 °F
MF:	C11H10O2

Molecular_Structure:	['1 . Molar refractive index 5106 ', '2 . Molar volume （m3/mol）1397 ', '3 . Parachor （902K）3820 ', '4 . Surface tension 558 ', '5 . Polarizability 2024']
Flash_Point:	>230 °F
Refractive_Index:	n20/D 1.586(lit.)
FW:	174.19600
Density:	1.122 g/mL at 25 °C(lit.)
Bolling_Point:	170 °C12 mm Hg(lit.)
Computational_Chemistry:	['1 . XlogP 26 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 1 ', '5 . TPSA 263 ', '6 . Heavy Atom Count 13 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 243 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 1 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
LogP:	2.60790
Melting_Point:	5 °C(lit.)
PSA:	26.30000
MF:	C11H10O2
More_Info:	['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）1122 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）5°C(lit) ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC, 12mmHg）170 ', '7 . Refractive indexn 20/D 1586(lit) ', '8 . Flash point（ºF）>230°F ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
Vapor_Pressure:	0.0013mmHg at 25°C
Exact_Mass:	174.06800