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10009-25-3

10009-25-3 | Benzoic acid, 4-(1,1,2,2-tetrafluoroethoxy)-

CAS No: 10009-25-3 Catalog No: AG0000W5 MDL No:MFCD00155926

Product Description

Catalog Number:
AG0000W5
Chemical Name:
Benzoic acid, 4-(1,1,2,2-tetrafluoroethoxy)-
CAS Number:
10009-25-3
Molecular Formula:
C9H6F4O3
Molecular Weight:
238.1358
MDL Number:
MFCD00155926
IUPAC Name:
4-(1,1,2,2-tetrafluoroethoxy)benzoic acid
InChI:
InChI=1S/C9H6F4O3/c10-8(11)9(12,13)16-6-3-1-5(2-4-6)7(14)15/h1-4,8H,(H,14,15)
InChI Key:
SVGWTILJZWYEMD-UHFFFAOYSA-N
SMILES:
FC(C(Oc1ccc(cc1)C(=O)O)(F)F)F

Properties

Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.025g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
238.138g/mol
Monoisotopic Mass:
238.025g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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