Home Other Building Blocks 8-(trifluoromethyl)isoquinoline

8-(trifluoromethyl)isoquinoline

CAS No.:
120568-10-7
Catalog Number:
AG01BXF2
Molecular Formula:
C10H6F3N
Molecular Weight:
197.1565
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Product Description
Catalog Number:
AG01BXF2
Chemical Name:
8-(trifluoromethyl)isoquinoline
CAS Number:
120568-10-7
Molecular Formula:
C10H6F3N
Molecular Weight:
197.1565
MDL Number:
MFCD12755889
IUPAC Name:
8-(trifluoromethyl)isoquinoline
InChI:
InChI=1S/C10H6F3N/c11-10(12,13)9-3-1-2-7-4-5-14-6-8(7)9/h1-6H
InChI Key:
ZZYLIBODFBDRNC-UHFFFAOYSA-N
SMILES:
FC(c1cccc2c1cncc2)(F)F
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.16g/mol
Monoisotopic Mass:
197.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties