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Home > Fluorides > 101054-97-1
101054-97-1 | 2-Butanol, 1,1,1-trifluoro-, (2R)-
CAS No: 101054-97-1 Catalog No: AG0003MM MDL No:
Product Description
Catalog Number:
AG0003MM
Chemical Name:
2-Butanol, 1,1,1-trifluoro-, (2R)-
CAS Number:
101054-97-1
Molecular Formula:
C4H7F3O
Molecular Weight:
128.0930
IUPAC Name:
(2R)-1,1,1-trifluorobutan-2-ol
InChI:
InChI=1S/C4H7F3O/c1-2-3(8)4(5,6)7/h3,8H,2H2,1H3/t3-/m1/s1
InChI Key:
IBWNUWSYEJOUAH-GSVOUGTGSA-N
SMILES:
CC[C@H](C(F)(F)F)O
Properties
Complexity:
68.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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