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289039-45-8 | Benzene, 2-chloro-4-ethoxy-1-fluoro-
CAS No: 289039-45-8 Catalog No: AG002X14 MDL No:MFCD00672984
Product Description
Catalog Number:
AG002X14
Chemical Name:
Benzene, 2-chloro-4-ethoxy-1-fluoro-
CAS Number:
289039-45-8
Molecular Formula:
C8H8ClFO
Molecular Weight:
174.5999
MDL Number:
MFCD00672984
IUPAC Name:
2-chloro-4-ethoxy-1-fluorobenzene
InChI:
InChI=1S/C8H8ClFO/c1-2-11-6-3-4-8(10)7(9)5-6/h3-5H,2H2,1H3
InChI Key:
FBCRDQDDPKYKBM-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1)Cl)F
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.599g/mol
Monoisotopic Mass:
174.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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