Home Other Building Blocks 2,2,2-trifluoro-1-(trimethyl-1H-pyrazol-4-yl)ethan-1-ol

2,2,2-trifluoro-1-(trimethyl-1H-pyrazol-4-yl)ethan-1-ol

CAS No.:
1250182-67-2
Catalog Number:
AG019ZXG
Molecular Formula:
C8H11F3N2O
Molecular Weight:
208.1809
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Product Description
Catalog Number:
AG019ZXG
Chemical Name:
2,2,2-trifluoro-1-(trimethyl-1H-pyrazol-4-yl)ethan-1-ol
CAS Number:
1250182-67-2
Molecular Formula:
C8H11F3N2O
Molecular Weight:
208.1809
MDL Number:
MFCD16067946
IUPAC Name:
2,2,2-trifluoro-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
InChI:
InChI=1S/C8H11F3N2O/c1-4-6(5(2)13(3)12-4)7(14)8(9,10)11/h7,14H,1-3H3
InChI Key:
VRIONNHWZSTHSG-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1C(C(F)(F)F)O)C)C
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.184g/mol
Monoisotopic Mass:
208.082g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties