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Home > Fluorides > 1417507-01-7
1417507-01-7 | 4-Allyl-2-fluoro-1-trifluoromethoxy-benzene
CAS No: 1417507-01-7 Catalog No: AG01FAYW MDL No:
Product Description
Catalog Number:
AG01FAYW
Chemical Name:
4-Allyl-2-fluoro-1-trifluoromethoxy-benzene
CAS Number:
1417507-01-7
Molecular Formula:
C10H8F4O
Molecular Weight:
220.1635
IUPAC Name:
2-fluoro-4-prop-2-enyl-1-(trifluoromethoxy)benzene
InChI:
InChI=1S/C10H8F4O/c1-2-3-7-4-5-9(8(11)6-7)15-10(12,13)14/h2,4-6H,1,3H2
InChI Key:
MMXYOGTXKHXLDX-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(c(c1)F)OC(F)(F)F
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.167g/mol
Monoisotopic Mass:
220.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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