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76243-24-8 | 1-(Benzyloxy);-2-fluoro-4-nitrobenzene
CAS No: 76243-24-8 Catalog No: AG003E0F MDL No:MFCD12925758
Product Description
Catalog Number:
AG003E0F
Chemical Name:
1-(Benzyloxy);-2-fluoro-4-nitrobenzene
CAS Number:
76243-24-8
Molecular Formula:
C13H10FNO3
Molecular Weight:
247.2218
MDL Number:
MFCD12925758
IUPAC Name:
2-fluoro-4-nitro-1-phenylmethoxybenzene
InChI:
InChI=1S/C13H10FNO3/c14-12-8-11(15(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:
KFEYJMWVGVVRBF-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1OCc1ccccc1)[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
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