FT-0615078 CAS:4485-89-6 chemical structure

3-ANILINOACROLEIN ANIL

Name: 3-ANILINOACROLEIN ANIL
Rating: 4.5 (11 reviews)

Catalog No: FT-0615078

CAS No: 4485-89-6

Molecular Formula: 222.28
Formula Weight: C15H14N2
Inchl Key: ZFYNTCNECVPHDZ-RMPAWCBFSA-N
Inchl: InChI=1S/C15H14N2/c1-3-8-14(9-4-1)16-12-7-13-17-15-10-5-2-6-11-15/h1-13,16H/b12-7+,17-13?

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

Product_Name:	3-Anilinoacrolein anil,
Flash_Point:	172.7ºC
Melting_Point:	111-113ºC
FW:	222.28500
Density:	0.98g/cm3
CAS:	4485-89-6
Bolling_Point:	361.9ºC at 760mmHg
MF:	C15H14N2

Molecular_Structure:	['1 . Molar refractive index 7268 ', '2 . Molar volume （m3/mol）2264 ', '3 . Parachor （902K）5634 ', '4 . Surface tension 383 ', '5 . Polarizability （10 -24cm 3）2881']
Flash_Point:	172.7ºC
Refractive_Index:	1.554
FW:	222.28500
Density:	0.98g/cm3
Bolling_Point:	361.9ºC at 760mmHg
Computational_Chemistry:	['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 244 ', '7 . Heavy Atom Count 17 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 246 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
LogP:	4.08770
Melting_Point:	111-113ºC
PSA:	24.39000
MF:	C15H14N2
More_Info:	['1 . Appearance Yellow 晶体粉末 ', '2 . Density（g/ml,20°C）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）111-113 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,20mmHg）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºC）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,20ºC）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']
Exact_Mass:	222.11600