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Home > Fluorides > 101054-93-7
101054-93-7 | 2-Butanol, 4,4,4-trifluoro-
CAS No: 101054-93-7 Catalog No: AG0003MN MDL No:MFCD07784221
Product Description
Catalog Number:
AG0003MN
Chemical Name:
2-Butanol, 4,4,4-trifluoro-
CAS Number:
101054-93-7
Molecular Formula:
C4H7F3O
Molecular Weight:
128.0930
MDL Number:
MFCD07784221
IUPAC Name:
4,4,4-trifluorobutan-2-ol
InChI:
InChI=1S/C4H7F3O/c1-3(8)2-4(5,6)7/h3,8H,2H2,1H3
InChI Key:
MZYWEUWEIXJBPQ-UHFFFAOYSA-N
SMILES:
CC(CC(F)(F)F)O
Properties
Complexity:
68.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.045g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.094g/mol
Monoisotopic Mass:
128.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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