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28987-48-6

28987-48-6 | Benzene, 4-ethoxy-2-fluoro-1-nitro-

CAS No: 28987-48-6 Catalog No: AG002V33 MDL No:MFCD04115633

Product Description

Catalog Number:
AG002V33
Chemical Name:
Benzene, 4-ethoxy-2-fluoro-1-nitro-
CAS Number:
28987-48-6
Molecular Formula:
C8H8FNO3
Molecular Weight:
185.1524
MDL Number:
MFCD04115633
IUPAC Name:
4-ethoxy-2-fluoro-1-nitrobenzene
InChI:
InChI=1S/C8H8FNO3/c1-2-13-6-3-4-8(10(11)12)7(9)5-6/h3-5H,2H2,1H3
InChI Key:
KTAIPPBHURYBBF-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)F)[N+](=O)[O-]

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.049g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.154g/mol
Monoisotopic Mass:
185.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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