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1178786-06-5

1178786-06-5 | 4-(2-chloro-4-nitrophenoxy)-3-fluorobenzaldehyde

CAS No: 1178786-06-5 Catalog No: AG01AI9E MDL No:MFCD18838955

Product Description

Catalog Number:
AG01AI9E
Chemical Name:
4-(2-chloro-4-nitrophenoxy)-3-fluorobenzaldehyde
CAS Number:
1178786-06-5
Molecular Formula:
C13H7ClFNO4
Molecular Weight:
295.6504
MDL Number:
MFCD18838955
IUPAC Name:
4-(2-chloro-4-nitrophenoxy)-3-fluorobenzaldehyde
InChI:
InChI=1S/C13H7ClFNO4/c14-10-6-9(16(18)19)2-4-12(10)20-13-3-1-8(7-17)5-11(13)15/h1-7H
InChI Key:
XIGDEDHEOAOOON-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)Oc1ccc(cc1Cl)[N+](=O)[O-]

Properties

Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.005g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.65g/mol
Monoisotopic Mass:
295.005g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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