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893738-88-0

893738-88-0 | 5-Pentafluorophenyl-2,3-dihydro-1H-indole

CAS No: 893738-88-0 Catalog No: AG01EYQ8 MDL No:

Product Description

Catalog Number:
AG01EYQ8
Chemical Name:
5-Pentafluorophenyl-2,3-dihydro-1H-indole
CAS Number:
893738-88-0
Molecular Formula:
C14H8F5N
Molecular Weight:
285.2120
IUPAC Name:
5-(2,3,4,5,6-pentafluorophenyl)-2,3-dihydro-1H-indole
InChI:
InChI=1S/C14H8F5N/c15-10-9(11(16)13(18)14(19)12(10)17)7-1-2-8-6(5-7)3-4-20-8/h1-2,5,20H,3-4H2
InChI Key:
NCVUHFXAPILPQU-UHFFFAOYSA-N
SMILES:
Fc1c(c2ccc3c(c2)CCN3)c(F)c(c(c1F)F)F

Properties

Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.058g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.217g/mol
Monoisotopic Mass:
285.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

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