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Home > Fluorides > 1233953-01-9
1233953-01-9 | 2-Fluoro-1-(3-methoxypropoxy)-4-nitrobenzene
CAS No: 1233953-01-9 Catalog No: AG01FAL2 MDL No:
Product Description
Catalog Number:
AG01FAL2
Chemical Name:
2-Fluoro-1-(3-methoxypropoxy)-4-nitrobenzene
CAS Number:
1233953-01-9
Molecular Formula:
C10H12FNO4
Molecular Weight:
229.2050
IUPAC Name:
2-fluoro-1-(3-methoxypropoxy)-4-nitrobenzene
InChI:
InChI=1S/C10H12FNO4/c1-15-5-2-6-16-10-4-3-8(12(13)14)7-9(10)11/h3-4,7H,2,5-6H2,1H3
InChI Key:
DBZHDXKZGUATPM-UHFFFAOYSA-N
SMILES:
COCCCOc1ccc(cc1F)[N+](=O)[O-]
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.207g/mol
Monoisotopic Mass:
229.075g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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