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Home Carbonyls 4-(Ethoxycarbonyl)benzoic acid

4-(Ethoxycarbonyl)benzoic acid

CAS No.:
713-57-5
Catalog Number:
AG00359U
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
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Purity
Availability
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Quantity
  
5g
95%
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United States
$979
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Product Description
Catalog Number:
AG00359U
Chemical Name:
4-(Ethoxycarbonyl)benzoic acid
CAS Number:
713-57-5
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00496597
IUPAC Name:
4-ethoxycarbonylbenzoic acid
InChI:
InChI=1S/C10H10O4/c1-2-14-10(13)8-5-3-7(4-6-8)9(11)12/h3-6H,2H2,1H3,(H,11,12)
InChI Key:
ADFVYWCDAKWKPH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)C(=O)O
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.186g/mol
Monoisotopic Mass:
194.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Dirhodium paddlewheel with functionalized carboxylate bridges: new building block for self-assembly and immobilization on solid support. Inorganic chemistry 20120416
Biodegradation of dimethyl terephthalate by Pasteurella multocida Sa follows an alternative biochemical pathway. Ecotoxicology (London, England) 20060501
Properties