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149526-96-5 | n-Butyl 3,3,3-trifluoro-2-hydroxypropanoate
CAS No: 149526-96-5 Catalog No: AG01FH0R MDL No:
Product Description
Catalog Number:
AG01FH0R
Chemical Name:
n-Butyl 3,3,3-trifluoro-2-hydroxypropanoate
CAS Number:
149526-96-5
IUPAC Name:
butyl 3,3,3-trifluoro-2-hydroxypropanoate
InChI:
InChI=1S/C7H11F3O3/c1-2-3-4-13-6(12)5(11)7(8,9)10/h5,11H,2-4H2,1H3
InChI Key:
GGJCELATQDWCKB-UHFFFAOYSA-N
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.157g/mol
Monoisotopic Mass:
200.066g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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