Home Other Building Blocks 2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine

2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine

CAS No.:
918514-78-0
Catalog Number:
AG01BHQ7
Molecular Formula:
C8H5F3N2
Molecular Weight:
186.1339
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Product Description
Catalog Number:
AG01BHQ7
Chemical Name:
2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine
CAS Number:
918514-78-0
Molecular Formula:
C8H5F3N2
Molecular Weight:
186.1339
MDL Number:
MFCD18258886
IUPAC Name:
2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C8H5F3N2/c9-8(10,11)6-4-5-2-1-3-12-7(5)13-6/h1-4H,(H,12,13)
InChI Key:
UXMRGLRMNQNTGP-UHFFFAOYSA-N
SMILES:
FC(c1cc2c([nH]1)nccc2)(F)F
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.137g/mol
Monoisotopic Mass:
186.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties