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86217-01-8 | 2-Propenoic acid,3,3,4,4,5,6,6,6-octafluoro-5-(trifluoromethyl)hexyl ester
CAS No: 86217-01-8 Catalog No: AG004K28 MDL No:
Product Description
Catalog Number:
AG004K28
Chemical Name:
2-Propenoic acid,3,3,4,4,5,6,6,6-octafluoro-5-(trifluoromethyl)hexyl ester
CAS Number:
86217-01-8
Molecular Formula:
C10H7F11O2
Molecular Weight:
368.1438
IUPAC Name:
[3,3,4,4,5,6,6,6-octafluoro-5-(trifluoromethyl)hexyl] prop-2-enoate
InChI:
InChI=1S/C10H7F11O2/c1-2-5(22)23-4-3-6(11,12)8(14,15)7(13,9(16,17)18)10(19,20)21/h2H,1,3-4H2
InChI Key:
UXVXKXDSDYDRTQ-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCCC(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.027g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
13
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.146g/mol
Monoisotopic Mass:
368.027g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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