Home Nitros 1-(Benzyloxy)-3-fluoro-5-nitrobenzene

1-(Benzyloxy)-3-fluoro-5-nitrobenzene

CAS No.:
1536920-33-8
Catalog Number:
AG00HY5P
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
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Product Description
Catalog Number:
AG00HY5P
Chemical Name:
1-(Benzyloxy)-3-fluoro-5-nitrobenzene
CAS Number:
1536920-33-8
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
MDL Number:
MFCD25019897
IUPAC Name:
1-fluoro-3-nitro-5-phenylmethoxybenzene
InChI:
InChI=1S/C13H10FNO3/c14-11-6-12(15(16)17)8-13(7-11)18-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
OCOUQAOYGUHIEI-UHFFFAOYSA-N
SMILES:
Fc1cc(OCc2ccccc2)cc(c1)[N+](=O)[O-]
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.064g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.225g/mol
Monoisotopic Mass:
247.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties