Home Other Building Blocks 1,2,4-Oxadiazole-3-methanol, 5-(trifluoromethyl)-

1,2,4-Oxadiazole-3-methanol, 5-(trifluoromethyl)-

CAS No.:
1260674-38-1
Catalog Number:
AG000R1V
Molecular Formula:
C4H3F3N2O2
Molecular Weight:
168.0740
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG000R1V
Chemical Name:
1,2,4-Oxadiazole-3-methanol, 5-(trifluoromethyl)-
CAS Number:
1260674-38-1
Molecular Formula:
C4H3F3N2O2
Molecular Weight:
168.0740
MDL Number:
MFCD11847842
IUPAC Name:
[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]methanol
InChI:
InChI=1S/C4H3F3N2O2/c5-4(6,7)3-8-2(1-10)9-11-3/h10H,1H2
InChI Key:
WFPHXHFHXMQXDJ-UHFFFAOYSA-N
SMILES:
OCc1noc(n1)C(F)(F)F
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.075g/mol
Monoisotopic Mass:
168.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties