Home Other Building Blocks 2-[(1,1,1-trifluoro-2-methylpropan-2-yl)oxy]acetic acid

2-[(1,1,1-trifluoro-2-methylpropan-2-yl)oxy]acetic acid

CAS No.:
942215-79-4
Catalog Number:
AG01ABOV
Molecular Formula:
C6H9F3O3
Molecular Weight:
186.1291
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Product Description
Catalog Number:
AG01ABOV
Chemical Name:
2-[(1,1,1-trifluoro-2-methylpropan-2-yl)oxy]acetic acid
CAS Number:
942215-79-4
Molecular Formula:
C6H9F3O3
Molecular Weight:
186.1291
MDL Number:
MFCD20660604
IUPAC Name:
2-(1,1,1-trifluoro-2-methylpropan-2-yl)oxyacetic acid
InChI:
InChI=1S/C6H9F3O3/c1-5(2,6(7,8)9)12-3-4(10)11/h3H2,1-2H3,(H,10,11)
InChI Key:
NZQXODKCWOJANP-UHFFFAOYSA-N
SMILES:
OC(=O)COC(C(F)(F)F)(C)C
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.05g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
186.13g/mol
Monoisotopic Mass:
186.05g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties