Home Other Building Blocks 2-ethyl-2-(trifluoromethyl)butan-1-ol

2-ethyl-2-(trifluoromethyl)butan-1-ol

CAS No.:
1955553-46-4
Catalog Number:
AG01C1HR
Molecular Formula:
C7H13F3O
Molecular Weight:
170.1727
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Product Description
Catalog Number:
AG01C1HR
Chemical Name:
2-ethyl-2-(trifluoromethyl)butan-1-ol
CAS Number:
1955553-46-4
Molecular Formula:
C7H13F3O
Molecular Weight:
170.1727
MDL Number:
MFCD30180319
IUPAC Name:
2-ethyl-2-(trifluoromethyl)butan-1-ol
InChI:
InChI=1S/C7H13F3O/c1-3-6(4-2,5-11)7(8,9)10/h11H,3-5H2,1-2H3
InChI Key:
GFYKMMXMUVFSDE-UHFFFAOYSA-N
SMILES:
CCC(C(F)(F)F)(CO)CC
Properties
Complexity:
115  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.092g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.175g/mol
Monoisotopic Mass:
170.092g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties