4,5-Dimethoxy-2-nitrobenzoic acid

Catalog No: FT-0621282

CAS No: 4998-07-6

Molecular Formula: 226.16
Formula Weight: C9H8NO6-
Inchl Key: WWCMFGBGMJAJRX-UHFFFAOYSA-M
Inchl: InChI=1S/C9H9NO6/c1-15-7-3-5(9(11)12)6(10(13)14)4-8(7)16-2/h3-4H,1-2H3,(H,11,12)/p-1

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

Symbol:	GHS07
CAS:	4998-07-6
Flash_Point:	201.4±28.7 °C
Product_Name:	4,5-Dimethoxy-2-nitrobenzoic acid
Bolling_Point:	409.5±45.0 °C at 760 mmHg
FW:	227.171
Melting_Point:	195-197 °C(lit.)
MF:	C9H9NO6
Density:	1.4±0.1 g/cm3

Refractive_Index:	1.570
Vapor_Pressure:	0.0±1.0 mmHg at 25°C
Flash_Point:	201.4±28.7 °C
LogP:	2.12
Bolling_Point:	409.5±45.0 °C at 760 mmHg
PSA:	101.58000
Molecular_Structure:	['1 . Molar refractive index 5308 ', '2 . Molar volume （m3/mol）1618 ', '3 . Parachor （902K）4382 ', '4 . Surface tension 537 ', '5 . Polarizability （10 -24cm 3）2104']
Computational_Chemistry:	['1 . XlogP 12 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 6 ', '4 . Rotatable Bond Count 3 ', '5 . TPSA 989 ', '6 . Heavy Atom Count 16 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 276 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 3']
Melting_Point:	195-197 °C(lit.)
MF:	C9H9NO6
Exact_Mass:	227.042984
FW:	227.171
Density:	1.4±0.1 g/cm3
More_Info:	['1 . Appearance Yellow 针状结晶，含05mol结晶Water ', '2 . Density（g/mL）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）194 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,3mmHg）不确定 ', '7 . Refractive index（nD20）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,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']

Symbol:	GHS07
Risk_Statements(EU):	R36/37/38
HS_Code:	2918990090
WGK_Germany:	3
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi:Irritant;
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335