200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 951888-71-4
951888-71-4 | 4'-(1,3-Dioxan-2-yl)-2-trifluoromethylbenzophenone
CAS No: 951888-71-4 Catalog No: AG01EZSL MDL No:
Product Description
Catalog Number:
AG01EZSL
Chemical Name:
4'-(1,3-Dioxan-2-yl)-2-trifluoromethylbenzophenone
CAS Number:
951888-71-4
Molecular Formula:
C18H15F3O3
Molecular Weight:
336.3051
IUPAC Name:
[4-(1,3-dioxan-2-yl)phenyl]-[2-(trifluoromethyl)phenyl]methanone
InChI:
InChI=1S/C18H15F3O3/c19-18(20,21)15-5-2-1-4-14(15)16(22)12-6-8-13(9-7-12)17-23-10-3-11-24-17/h1-2,4-9,17H,3,10-11H2
InChI Key:
QBDASSDHEKUPOU-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1C(F)(F)F)c1ccc(cc1)C1OCCCO1
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.097g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.31g/mol
Monoisotopic Mass:
336.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
© 2019 Angene International Limited. All rights Reserved.