200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1443336-60-4
1443336-60-4 | 3'-Chloro-4'-iso-pentoxy-2,2,2-trifluoroacetophenone
CAS No: 1443336-60-4 Catalog No: AG01F8K7 MDL No:
Product Description
Catalog Number:
AG01F8K7
Chemical Name:
3'-Chloro-4'-iso-pentoxy-2,2,2-trifluoroacetophenone
CAS Number:
1443336-60-4
Molecular Formula:
C13H14ClF3O2
Molecular Weight:
294.6973
IUPAC Name:
1-[3-chloro-4-(3-methylbutoxy)phenyl]-2,2,2-trifluoroethanone
InChI:
InChI=1S/C13H14ClF3O2/c1-8(2)5-6-19-11-4-3-9(7-10(11)14)12(18)13(15,16)17/h3-4,7-8H,5-6H2,1-2H3
InChI Key:
BKGVIALTVVMIEL-UHFFFAOYSA-N
SMILES:
CC(CCOc1ccc(cc1Cl)C(=O)C(F)(F)F)C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.063g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.698g/mol
Monoisotopic Mass:
294.063g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
Related Products
© 2019 Angene International Limited. All rights Reserved.