Molecular Formula: 160.17
Formula Weight: C7H12O4
Inchl Key: BTUDGPVTCYNYLK-UHFFFAOYSA-N
Inchl: InChI=1S/C7H12O4/c1-7(2,6(10)11)4-3-5(8)9/h3-4H2,1-2H3,(H,8,9)(H,10,11)

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:	149.7±16.9 °C
FW:	160.168
Bolling_Point:	300.4±15.0 °C at 760 mmHg
Product_Name:	2,2-Dimethylpentanedioic acid
CAS:	681-57-2
MF:	C7H12O4
Melting_Point:	82-86 °C(lit.)
Density:	1.2±0.1 g/cm3

PSA:	74.60000
Bolling_Point:	300.4±15.0 °C at 760 mmHg
Molecular_Structure:	['1 . Molar refractive index 3757 ', '2 . Molar volume （m3/mol）1333 ', '3 . Parachor （902K）3493 ', '4 . Surface tension 470 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 1489']
LogP:	-0.34
More_Info:	['1 . Appearance 微White 粉末。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）83-85 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '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 Unknow。']
MF:	C7H12O4
Computational_Chemistry:	['1 . XlogP 07 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 4 ', '5 . TPSA 746 ', '6 . Heavy Atom Count 11 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 171 ', '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 1']
Melting_Point:	82-86 °C(lit.)
Refractive_Index:	1.475
Flash_Point:	149.7±16.9 °C
FW:	160.168
Exact_Mass:	160.073563
Vapor_Pressure:	0.0±1.3 mmHg at 25°C
Density:	1.2±0.1 g/cm3

Hazard_Codes:	Xi
WGK_Germany:	3
Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
HS_Code:	29171990
Risk_Statements(EU):	R36/37/38
Safety_Statements:	S22-S24/25
RIDADR:	NONH for all modes of transport