Molecular Formula: 174.24
Formula Weight: C11H14N2
Inchl Key: OCDGBSUVYYVKQZ-UHFFFAOYSA-N
Inchl: InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3

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

Flash_Point:	131.5±20.4 °C
FW:	174.242
Bolling_Point:	293.9±15.0 °C at 760 mmHg
Product_Name:	Gramine
CAS:	87-52-5
MF:	C11H14N2
Melting_Point:	132-134 °C(lit.)
Density:	1.1±0.1 g/cm3

Water_Solubility:	PRACTICALLY INSOLUBLE
Bolling_Point:	293.9±15.0 °C at 760 mmHg
Molecular_Structure:	['1 . Molar refractive index 5643 ', '2 . Molar volume （m3/mol）1584 ', '3 . Parachor （902K）4127 ', '4 . Surface tension 460 ', '5 . Polarizability 2237']
LogP:	1.90
More_Info:	['1 . Appearance 叶片状or 针状结晶 ', '2 . Density（g/mL,25/4℃）未来确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）未来确定 ', '4 . Melting point（ºC）138-139℃ ', '5 . Boiling point（ºC,Atmospheric pressure）未来确定 ', '6 . Boiling point（ºC,52kPa）未来确定 ', '7 . Refractive index未来确定 ', '8 . Flash point（ºC）167°C ', '9 . Specific rotation（º）未来确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）未来确定 ', '11 . Vapor pressure（kPa,25ºC）未来确定 ', '12 . Saturated vapor pressure（kPa,60ºC）未来确定 ', '13 . Combustion heat（KJ/mol）未来确定 ', '14 . Critical temperature（ºC）未来确定 ', '15 . Critical pressure（KPa）未来确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 未来确定 ', '17 . Upper limit of explosion（%,V/V）未来确定 ', '18 . Lower limit of explosion（%,V/V）未来确定 ', '19 . Solubility Soluble in 醇醚氯仿，微Soluble in 冷丙酮，几乎未来Soluble in Water and 石油醚']
MF:	C11H14N2
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 19 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :168 ', '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:	132-134 °C(lit.)
Refractive_Index:	1.631
PSA:	19.03000
Flash_Point:	131.5±20.4 °C
FW:	174.242
Exact_Mass:	174.115692
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Density:	1.1±0.1 g/cm3

Hazard_Codes:	Xi:Irritant;
RTECS:	NL7525000
WGK_Germany:	3
HS_Code:	2933990090
Risk_Statements(EU):	R36
Safety_Statements:	S45-S36/37/39-S26
RIDADR:	NONH for all modes of transport