Home Other Building Blocks [1-(2,2,2-trifluoroethyl)-1H-imidazol-5-yl]methanol

[1-(2,2,2-trifluoroethyl)-1H-imidazol-5-yl]methanol

CAS No.:
1488678-34-7
Catalog Number:
AG01BGSF
Molecular Formula:
C6H7F3N2O
Molecular Weight:
180.1278
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Product Description
Catalog Number:
AG01BGSF
Chemical Name:
[1-(2,2,2-trifluoroethyl)-1H-imidazol-5-yl]methanol
CAS Number:
1488678-34-7
Molecular Formula:
C6H7F3N2O
Molecular Weight:
180.1278
MDL Number:
MFCD21704380
IUPAC Name:
[3-(2,2,2-trifluoroethyl)imidazol-4-yl]methanol
InChI:
InChI=1S/C6H7F3N2O/c7-6(8,9)3-11-4-10-1-5(11)2-12/h1,4,12H,2-3H2
InChI Key:
IVCFRVLWODKSFC-UHFFFAOYSA-N
SMILES:
OCc1cncn1CC(F)(F)F
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.13g/mol
Monoisotopic Mass:
180.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties