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42175-48-4

42175-48-4 | 1,2,3-Tris(trifluoromethyl)benzene

CAS No: 42175-48-4 Catalog No: AG01EVWU MDL No:MFCD18379797

Product Description

Catalog Number:
AG01EVWU
Chemical Name:
1,2,3-Tris(trifluoromethyl)benzene
CAS Number:
42175-48-4
Molecular Formula:
C9H3F9
Molecular Weight:
282.1057
MDL Number:
MFCD18379797
IUPAC Name:
1,2,3-tris(trifluoromethyl)benzene
InChI:
InChI=1S/C9H3F9/c10-7(11,12)4-2-1-3-5(8(13,14)15)6(4)9(16,17)18/h1-3H
InChI Key:
RXJLQXXWAYTRIW-UHFFFAOYSA-N
SMILES:
FC(c1c(cccc1C(F)(F)F)C(F)(F)F)(F)F

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.009g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.109g/mol
Monoisotopic Mass:
282.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  

Literature

Title Journal
Stitching phospholanes together piece by piece: new modular di- and tridentate stereodirecting ligands. Chemistry (Weinheim an der Bergstrasse, Germany) 20111209

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