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Home > Fluorides > 1214333-01-3
1214333-01-3 | Ethanone, 1-[3-(difluoromethoxy)-4-fluorophenyl]-
CAS No: 1214333-01-3 Catalog No: AG0014T4 MDL No:
Product Description
Catalog Number:
AG0014T4
Chemical Name:
Ethanone, 1-[3-(difluoromethoxy)-4-fluorophenyl]-
CAS Number:
1214333-01-3
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
IUPAC Name:
1-[3-(difluoromethoxy)-4-fluorophenyl]ethanone
InChI:
InChI=1S/C9H7F3O2/c1-5(13)6-2-3-7(10)8(4-6)14-9(11)12/h2-4,9H,1H3
InChI Key:
MDEJHXUTJKNRNQ-UHFFFAOYSA-N
SMILES:
FC(Oc1cc(ccc1F)C(=O)C)F
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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