200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 24993-87-1
24993-87-1 | 1-Octanone, 1-(4-ethenylphenyl)-
CAS No: 24993-87-1 Catalog No: AG002Q4R MDL No:
Product Description
Catalog Number:
AG002Q4R
Chemical Name:
1-Octanone, 1-(4-ethenylphenyl)-
CAS Number:
24993-87-1
Molecular Formula:
C16H22O
Molecular Weight:
230.3453
IUPAC Name:
1-(4-ethenylphenyl)octan-1-one
InChI:
InChI=1S/C16H22O/c1-3-5-6-7-8-9-16(17)15-12-10-14(4-2)11-13-15/h4,10-13H,2-3,5-9H2,1H3
InChI Key:
ZMFLFMYBKRKQIK-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)c1ccc(cc1)C=C
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.167g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.351g/mol
Monoisotopic Mass:
230.167g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
Literature
| Title | Journal |
|---|---|
| Synthesis of the key intermediate, diethyl 2-acetylamino-2-(2-(4-octanoylphenyl)ethyl)propane-1,3-dioate, of the immunomodulatory agent FTY720 (fingolimod). | Chemical & pharmaceutical bulletin 20080401 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.