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118994-90-4

118994-90-4 | Oxazole-5-carboxylic acid

CAS No: 118994-90-4 Catalog No: AG0038BB MDL No:MFCD04114931

Product Description

Catalog Number:
AG0038BB
Chemical Name:
Oxazole-5-carboxylic acid
CAS Number:
118994-90-4
Molecular Formula:
C4H3NO3
Molecular Weight:
113.0715
MDL Number:
MFCD04114931
IUPAC Name:
1,3-oxazole-5-carboxylic acid
InChI:
InChI=1S/C4H3NO3/c6-4(7)3-1-5-2-8-3/h1-2H,(H,6,7)
InChI Key:
QCGMEWVZBGQOFN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnco1

Properties

Complexity:
104  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.011g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
113.072g/mol
Monoisotopic Mass:
113.011g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

Literature

Title Journal
beta(2) and beta(3)-adrenoceptor inhibition of alpha(1)-adrenoceptor-stimulated Ca(2+) elevation in human cultured prostatic stromal cells. European journal of pharmacology 20070910

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