Home Carboxys ethyl 4-(trifluoromethyl)-1,3-oxazole-5-carboxylate

ethyl 4-(trifluoromethyl)-1,3-oxazole-5-carboxylate

CAS No.:
1126633-32-6
Catalog Number:
AG0095EZ
Molecular Formula:
C7H6F3NO3
Molecular Weight:
209.1226
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Product Description
Catalog Number:
AG0095EZ
Chemical Name:
ethyl 4-(trifluoromethyl)-1,3-oxazole-5-carboxylate
CAS Number:
1126633-32-6
Molecular Formula:
C7H6F3NO3
Molecular Weight:
209.1226
MDL Number:
MFCD11111646
IUPAC Name:
ethyl 4-(trifluoromethyl)-1,3-oxazole-5-carboxylate
InChI:
InChI=1S/C7H6F3NO3/c1-2-13-6(12)4-5(7(8,9)10)11-3-14-4/h3H,2H2,1H3
InChI Key:
XNWPXJFSPSKGHM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ocnc1C(F)(F)F
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.03g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.124g/mol
Monoisotopic Mass:
209.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties