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681-57-2

Name 2,2-Dimethylglutaric acid
CAS 681-57-2
EINECS(EC#) 211-655-9
Molecular Formula C7H12O4
MDL Number MFCD00004197
Molecular Weight 160.17
MOL File 681-57-2.mol
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Chemical Properties

Appearance white granular powder
Melting point  82-86 °C (lit.)
Boiling point  200 °C / 2mmHg
density  1.3681 (rough estimate)
refractive index  1.4328 (estimate)
storage temp.  Sealed in dry,2-8°C
form  powder to crystal
pka 4.58±0.10(Predicted)
color  White to Almost white
Water Solubility  It hydrolyzes with water.
BRN  1768501
InChI InChI=1S/C7H12O4/c1-7(2,6(10)11)4-3-5(8)9/h3-4H2,1-2H3,(H,8,9)(H,10,11)
InChIKey BTUDGPVTCYNYLK-UHFFFAOYSA-N
SMILES C(O)(=O)C(C)(C)CCC(O)=O
CAS DataBase Reference 681-57-2(CAS DataBase Reference)
NIST Chemistry Reference 2,2-Dimethylglutaric acid(681-57-2)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
HS Code  29171990
Storage Class 11 - Combustible Solids

Hazard Information

Material Safety Data Sheet(MSDS)

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