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Home > Fluorides > 144006-68-8
144006-68-8 | Oxirane, 2-[[4-(1,1,2,2,3,3,3-heptafluoropropyl)phenyl]methyl]-
CAS No: 144006-68-8 Catalog No: AG001IRI MDL No:
Product Description
Catalog Number:
AG001IRI
Chemical Name:
Oxirane, 2-[[4-(1,1,2,2,3,3,3-heptafluoropropyl)phenyl]methyl]-
CAS Number:
144006-68-8
Molecular Formula:
C12H9F7O
Molecular Weight:
302.1881
IUPAC Name:
2-[[4-(1,1,2,2,3,3,3-heptafluoropropyl)phenyl]methyl]oxirane
InChI:
InChI=1S/C12H9F7O/c13-10(14,11(15,16)12(17,18)19)8-3-1-7(2-4-8)5-9-6-20-9/h1-4,9H,5-6H2
InChI Key:
CEXDSECOBNBQNX-UHFFFAOYSA-N
SMILES:
FC(C(C(F)(F)F)(F)F)(c1ccc(cc1)CC1OC1)F
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.054g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.192g/mol
Monoisotopic Mass:
302.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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