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1443353-53-4

1443353-53-4 | 2-[(1,3-Dioxolan-2-yl)methoxy]benzotrifluoride

CAS No: 1443353-53-4 Catalog No: AG01FA52 MDL No:

Product Description

Catalog Number:
AG01FA52
Chemical Name:
2-[(1,3-Dioxolan-2-yl)methoxy]benzotrifluoride
CAS Number:
1443353-53-4
Molecular Formula:
C11H11F3O3
Molecular Weight:
248.1984
IUPAC Name:
2-[[2-(trifluoromethyl)phenoxy]methyl]-1,3-dioxolane
InChI:
InChI=1S/C11H11F3O3/c12-11(13,14)8-3-1-2-4-9(8)17-7-10-15-5-6-16-10/h1-4,10H,5-7H2
InChI Key:
HBSPXSMAWFESER-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1OCC1OCCO1)(F)F

Properties

Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.066g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.201g/mol
Monoisotopic Mass:
248.066g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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