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Home > Fluorides > 912617-68-6
912617-68-6 | 3-Fluoro-4-(trifluoromethoxy)phenylacetylene
CAS No: 912617-68-6 Catalog No: AG003JFK MDL No:
Product Description
Catalog Number:
AG003JFK
Chemical Name:
3-Fluoro-4-(trifluoromethoxy)phenylacetylene
CAS Number:
912617-68-6
IUPAC Name:
4-ethynyl-2-fluoro-1-(trifluoromethoxy)benzene
InChI:
InChI=1S/C9H4F4O/c1-2-6-3-4-8(7(10)5-6)14-9(11,12)13/h1,3-5H
InChI Key:
MTPNHEDDMZRILD-UHFFFAOYSA-N
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.124g/mol
Monoisotopic Mass:
204.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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