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1260787-46-9

1260787-46-9 | 1H-Indole, 5-methoxy-7-(trifluoromethyl)-

CAS No: 1260787-46-9 Catalog No: AG000R9L MDL No:

Product Description

Catalog Number:
AG000R9L
Chemical Name:
1H-Indole, 5-methoxy-7-(trifluoromethyl)-
CAS Number:
1260787-46-9
Molecular Formula:
C10H8F3NO
Molecular Weight:
215.1718
IUPAC Name:
5-methoxy-7-(trifluoromethyl)-1H-indole
InChI:
InChI=1S/C10H8F3NO/c1-15-7-4-6-2-3-14-9(6)8(5-7)10(11,12)13/h2-5,14H,1H3
InChI Key:
VBKWRJMLRKUTFD-UHFFFAOYSA-N
SMILES:
COc1cc2cc[nH]c2c(c1)C(F)(F)F

Properties

Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.056g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.175g/mol
Monoisotopic Mass:
215.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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