Home Fluorides 101054-93-7
101054-93-7,MFCD07784221
Catalog No.:AA0003JV
101054-93-7 | 4,4,4-Trifluoro-2-butanol
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250mg
95%
in stock  
$172.00   $120.00
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1g
95%
in stock  
$445.00   $312.00
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  • Technical Information
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Technical Information
Catalog Number:
AA0003JV
Chemical Name:
4,4,4-Trifluoro-2-butanol
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
Computed 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  

Synonyms
 
4,4,4-trifluorobutan-2-ol 
101054-93-7 
2-Hydroxy-4,4,4-trifluorobutane 
MFCD07784221 
SBB085706 
AKOS010652157 
RTX-013128 
Z6338 
K-0207 
C4H7F3O 
CID10285793 
4,4,4-TRIFLUORO-2-BUTANOL 
2-Butanol,4,4,4-trifluoro- 
ACMC-1BPVR 
SCHEMBL1445373 
CTK3J9502 
2-Butanol, 4,4,4-trifluoro- 
DTXSID70437748 
MZYWEUWEIXJBPQ-UHFFFAOYSA-N 
Literature
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