Home Carboxys 2-phenoxy-1,3-oxazole-4-carboxylic acid

2-phenoxy-1,3-oxazole-4-carboxylic acid

CAS No.:
1048919-23-8
Catalog Number:
AG01EK9Z
Molecular Formula:
C10H7NO4
Molecular Weight:
205.1669
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Product Description
Catalog Number:
AG01EK9Z
Chemical Name:
2-phenoxy-1,3-oxazole-4-carboxylic acid
CAS Number:
1048919-23-8
Molecular Formula:
C10H7NO4
Molecular Weight:
205.1669
MDL Number:
MFCD11053088
IUPAC Name:
2-phenoxy-1,3-oxazole-4-carboxylic acid
InChI:
InChI=1S/C10H7NO4/c12-9(13)8-6-14-10(11-8)15-7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key:
MSLQXSBLPAZCKR-UHFFFAOYSA-N
SMILES:
OC(=O)c1coc(n1)Oc1ccccc1
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.038g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.169g/mol
Monoisotopic Mass:
205.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties