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516481-95-1

516481-95-1 | 4-(4-chloro-3-(trifluoromethyl)phenoxy)benzaldehyde

CAS No: 516481-95-1 Catalog No: AG01DJF8 MDL No:MFCD28404288

Product Description

Catalog Number:
AG01DJF8
Chemical Name:
4-(4-chloro-3-(trifluoromethyl)phenoxy)benzaldehyde
CAS Number:
516481-95-1
Molecular Formula:
C14H8ClF3O2
Molecular Weight:
300.6603
MDL Number:
MFCD28404288
IUPAC Name:
4-[4-chloro-3-(trifluoromethyl)phenoxy]benzaldehyde
InChI:
InChI=1S/C14H8ClF3O2/c15-13-6-5-11(7-12(13)14(16,17)18)20-10-3-1-9(8-19)2-4-10/h1-8H
InChI Key:
PRYWVXRFNZLRKO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Oc1ccc(c(c1)C(F)(F)F)Cl

Properties

Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.016g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.661g/mol
Monoisotopic Mass:
300.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

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