Home Categories Chemical Reagents Coumalic Acid
A2577612

Coumalic Acid , >97.0%(GC)(T) , 500-05-0

Synonym(s):
2-Oxo-2H-pyran-5-carboxylic acid;2-Pyrone-5-carboxylic acid

CAS NO.:500-05-0

Empirical Formula: C6H4O4

Molecular Weight: 140.09

MDL number: MFCD00006644

EINECS: 207-899-0

Pack Size Price Stock Quantity
1g RMB50.40 In Stock
5G RMB159.20 In Stock
25G RMB543.20 In Stock
100g RMB1615.20 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Melting point: 203-205 °C (dec.) (lit.)
Boiling point: 218 °C/120 mmHg (lit.)
Density  1.2154 (rough estimate)
refractive index  1.4434 (estimate)
Flash point: 218°C/120mm
storage temp.  Sealed in dry,Room Temperature
form  powder to crystal
pka 2.80±0.20(Predicted)
color  White to Light yellow to Light orange
Water Solubility  Very soluble in water.
Merck  14,2557
BRN  119747
InChI 1S/C6H4O4/c7-5-2-1-4(3-10-5)6(8)9/h1-3H,(H,8,9)
InChIKey ORGPJDKNYMVLFL-UHFFFAOYSA-N
SMILES OC(=O)C1=COC(=O)C=C1
LogP 0.411 (est)
CAS DataBase Reference 500-05-0(CAS DataBase Reference)
NIST Chemistry Reference 2H-Pyran-5-carboxylic acid, 2-oxo-(500-05-0)
EPA Substance Registry System 2H-Pyran-5-carboxylic acid, 2-oxo- (500-05-0)

Description and Uses

Coumalic acid undergoes thermal reaction with 1,3-butadiene to yield dimethyl tricycle[3.2.1.02,7]oct-3-ene-2,4-dicarboxylate.

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
PPE Eyeshields, Gloves, type N95 (US)
Hazard Codes  Xi
Safety Statements  22-24/25
WGK Germany  3
TSCA  TSCA listed
HS Code  29322090
Storage Class 11 - Combustible Solids

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