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Home > Fluorides > 821799-52-4
821799-52-4 | Benzene, [1-ethenyl-1-(trifluoromethyl)nonyl]-
CAS No: 821799-52-4 Catalog No: AG0050K5 MDL No:
Product Description
Catalog Number:
AG0050K5
Chemical Name:
Benzene, [1-ethenyl-1-(trifluoromethyl)nonyl]-
CAS Number:
821799-52-4
Molecular Formula:
C18H25F3
Molecular Weight:
298.3863
IUPAC Name:
3-(trifluoromethyl)undec-1-en-3-ylbenzene
InChI:
InChI=1S/C18H25F3/c1-3-5-6-7-8-12-15-17(4-2,18(19,20)21)16-13-10-9-11-14-16/h4,9-11,13-14H,2-3,5-8,12,15H2,1H3
InChI Key:
RSAIGMVTVGEUDO-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(C(F)(F)F)(c1ccccc1)C=C
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.191g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.393g/mol
Monoisotopic Mass:
298.191g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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