Home Other Building Blocks 2,2,2-trifluoro-1-(pyrazin-2-yl)ethanol

2,2,2-trifluoro-1-(pyrazin-2-yl)ethanol

CAS No.:
1341518-87-3
Catalog Number:
AG01DVAP
Molecular Formula:
C6H5F3N2O
Molecular Weight:
178.1119
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Product Description
Catalog Number:
AG01DVAP
Chemical Name:
2,2,2-trifluoro-1-(pyrazin-2-yl)ethanol
CAS Number:
1341518-87-3
Molecular Formula:
C6H5F3N2O
Molecular Weight:
178.1119
MDL Number:
MFCD19622683
IUPAC Name:
2,2,2-trifluoro-1-pyrazin-2-ylethanol
InChI:
InChI=1S/C6H5F3N2O/c7-6(8,9)5(12)4-3-10-1-2-11-4/h1-3,5,12H
InChI Key:
XPQOAMXGEIAXRT-UHFFFAOYSA-N
SMILES:
OC(C(F)(F)F)c1nccnc1
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.114g/mol
Monoisotopic Mass:
178.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties