200,000+ products from a single source!
sales@angenechem.com
88176-41-4 | 1,3-Cyclohexanedione, 5-(3-fluoro-2,4,5,6-tetramethylphenyl)-
CAS No: 88176-41-4 Catalog No: AG004CMU MDL No:
Product Description
Catalog Number:
AG004CMU
Chemical Name:
1,3-Cyclohexanedione, 5-(3-fluoro-2,4,5,6-tetramethylphenyl)-
CAS Number:
88176-41-4
Molecular Formula:
C16H19FO2
Molecular Weight:
262.3193
IUPAC Name:
5-(3-fluoro-2,4,5,6-tetramethylphenyl)cyclohexane-1,3-dione
InChI:
InChI=1S/C16H19FO2/c1-8-9(2)15(11(4)16(17)10(8)3)12-5-13(18)7-14(19)6-12/h12H,5-7H2,1-4H3
InChI Key:
NYOQBUPAMZYUQV-UHFFFAOYSA-N
SMILES:
O=C1CC(=O)CC(C1)c1c(C)c(C)c(c(c1C)F)C
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.137g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.324g/mol
Monoisotopic Mass:
262.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.