Home Other Building Blocks 4-(trifluoromethyl)-1,3-oxazole

4-(trifluoromethyl)-1,3-oxazole

CAS No.:
2044772-79-2
Catalog Number:
AG01B7CG
Molecular Formula:
C4H2F3NO
Molecular Weight:
137.0600
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Product Description
Catalog Number:
AG01B7CG
Chemical Name:
4-(trifluoromethyl)-1,3-oxazole
CAS Number:
2044772-79-2
Molecular Formula:
C4H2F3NO
Molecular Weight:
137.0600
MDL Number:
MFCD30476152
IUPAC Name:
4-(trifluoromethyl)-1,3-oxazole
InChI:
InChI=1S/C4H2F3NO/c5-4(6,7)3-1-9-2-8-3/h1-2H
InChI Key:
CEDFOMFDWLUWGV-UHFFFAOYSA-N
SMILES:
FC(c1ncoc1)(F)F
Properties
Complexity:
103  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.009g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.061g/mol
Monoisotopic Mass:
137.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties