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Sertraline

Catalog No: FT-0630872

CAS No: 79617-96-2

Chemical Name: Sertraline
Molecular Formula: C17H17Cl2N
Molecular Weight: 306.2 g/mol
InChI Key: VGKDLMBJGBXTGI-SJCJKPOMSA-N
InChI: InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1

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:	188-190 °C(lit.)
CAS:	79617-96-2
MF:	C17H17Cl2N
Flash_Point:	205.6±28.7 °C
Product_Name:	Sertraline
Density:	1.3±0.1 g/cm3
FW:	306.230
Bolling_Point:	416.3±45.0 °C at 760 mmHg

Refractive_Index:	1.621
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Flash_Point:	205.6±28.7 °C
LogP:	4.81
Bolling_Point:	416.3±45.0 °C at 760 mmHg
FW:	306.230
PSA:	12.03000
Computational_Chemistry:	['1. XlogP :48 ', '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 12 ', '7. Heavy Atom Count :20 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :322 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :2 ', '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:	188-190 °C(lit.)
MF:	C17H17Cl2N
Exact_Mass:	305.073792
Molecular_Structure:	['1 . Molar refractive index 8582 ', '2 . Molar volume （m3/mol）2439 ', '3 . Parachor （902K）6449 ', '4 . Surface tension 488 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 3402']
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance 。 ', '2 . Density（g/mL,25/4℃） ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC） ', '5 . Boiling point（ºC,Atmospheric pressure） ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '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 。']