Home Carboxys Ethyl coumarin-3-carboxylate

Ethyl coumarin-3-carboxylate

CAS No.:
1846-76-0
Catalog Number:
AG003QEN
Molecular Formula:
C12H10O4
Molecular Weight:
218.2054
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 98% (HPLC)
1 week
United States
$53
- +
5g
≥ 98% (HPLC)
1 week
United States
$83
- +
25g
≥ 98% (HPLC)
1 week
United States
$182
- +
100g
≥ 98% (HPLC)
1 week
United States
$553
- +
250g
≥ 98% (HPLC)
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG003QEN
Chemical Name:
Ethyl coumarin-3-carboxylate
CAS Number:
1846-76-0
Molecular Formula:
C12H10O4
Molecular Weight:
218.2054
MDL Number:
MFCD00016964
IUPAC Name:
ethyl 2-oxochromene-3-carboxylate
InChI:
InChI=1S/C12H10O4/c1-2-15-11(13)9-7-8-5-3-4-6-10(8)16-12(9)14/h3-7H,2H2,1H3
InChI Key:
XKHPEMKBJGUYCM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2ccccc2oc1=O
UNII:
27EAZ97E5V
NSC Number:
620
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.058g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.208g/mol
Monoisotopic Mass:
218.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Photoinduced electron transfer in photorobust coumarins linked with electron donors affording long lifetimes of triplet charge-separated states. Chemphyschem : a European journal of chemical physics and physical chemistry 20100823
Effect of the synthetic coumarin, ethyl 2-oxo-2H-chromene-3-carboxylate, on activity of Crotalus durissus ruruima sPLA2 as well as on edema and platelet aggregation induced by this factor. Toxicon : official journal of the International Society on Toxinology 20100701
Ethyl 4-(2-fur-yl)-2-oxochroman-3-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20100601
alpha-Glucosidase inhibitory antihyperglycemic activity of substituted chromenone derivatives. Bioorganic & medicinal chemistry 20100101
Biological activity of 3-formylchromones and related compounds. In vivo (Athens, Greece) 20070101
First total synthesis of (+/-)-Linderol A, a tricyclic hexahydrodibenzofuran constituent of Lindera umbellata bark, with potent inhibitory activity on melanin biosynthesis of cultured B-16 melanoma cells. The Journal of organic chemistry 20030221
Properties