Basic information Safety Supplier Related

TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID

Basic information Safety Supplier Related

TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID Basic information

Product Name:
TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID
Synonyms:
  • SPECS AB-131/40227215
  • RARECHEM AL BO 2332
  • TRANS-1,2-CYCLOBUTANEDICARBOXYLIC ACID
  • TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID
  • (e)-2-cyclobutanedicarboxylicacid
  • 1,2-Cyclobutanedicarboxylic acid
  • 1,2-Cyclobutanedicarboxylic acid, (E)-
  • 1,2-Cyclobutanedicarboxylic acid, trans-
CAS:
1124-13-6
MF:
C6H8O4
MW:
144.13
EINECS:
214-392-8
Product Categories:
  • C6
  • Carbonyl Compounds
  • Carboxylic Acids
Mol File:
1124-13-6.mol
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TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID Chemical Properties

Melting point:
125-131 °C
Boiling point:
140 °C(Press: 2 Torr)
Density 
1.509±0.06 g/cm3(Predicted)
refractive index 
1.4556 (589.3 nm 25℃)
storage temp. 
2-8°C
pka
pK1:3.79 ;pK2:5.61 (25°C)
BRN 
3198993
InChIKey
SUSAGCZZQKACKE-QWWZWVQMSA-N
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-37/39
WGK Germany 
3
RTECS 
GU1680000
HS Code 
2917200090

MSDS

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TRANS-CYCLOBUTANE-1,2-DICARBOXYLIC ACID Usage And Synthesis

General Description

The interaction of the carboxyl groups in the fragmentation of the molecular ions of cis-cyclobutane-1,2-dicarboxylic acid helps to distinguish it from trans-cyclobutane-1,2-dicarboxylic acid.

Purification Methods

Crystallise the acid from *C6H6 or *C6H6/EtOAc. The diphenacyl ester has m 98o (from EtOH) and the p-bromodiphenacyl ester has m 158o (from EtOH). The cis-acid isomerizes to the trans-acid on heating in conc HCl at 190o. [Reed J Chem Soc 685 1951, Fison et al. J Am Chem Soc 51 1536 1929, Fison et al. J Am Chem Soc 56 1774 1934, pK: Bode Chem Ber 67 332 1934, Beilstein 9 IV 2788.]

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