200,000+ products from a single source!
sales@angenechem.com
89351-88-2 | 3-Octen-2-one, 4-butyl-1,1,1-trifluoro-
CAS No: 89351-88-2 Catalog No: AG003Y1X MDL No:
Product Description
Catalog Number:
AG003Y1X
Chemical Name:
3-Octen-2-one, 4-butyl-1,1,1-trifluoro-
CAS Number:
89351-88-2
Molecular Formula:
C12H19F3O
Molecular Weight:
236.2739
IUPAC Name:
4-butyl-1,1,1-trifluorooct-3-en-2-one
InChI:
InChI=1S/C12H19F3O/c1-3-5-7-10(8-6-4-2)9-11(16)12(13,14)15/h9H,3-8H2,1-2H3
InChI Key:
AJSYGJSJVNNSPN-UHFFFAOYSA-N
SMILES:
CCCCC(=CC(=O)C(F)(F)F)CCCC
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.139g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.278g/mol
Monoisotopic Mass:
236.139g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.