Home Fluorides 455-01-6
455-01-6,MFCD00009710
Catalog No.:AA003I85
455-01-6 | 3-(Trifluoromethyl)phenethyl alcohol
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1g
97%
in stock  
$65.00   $45.00
- +
5g
97%
in stock  
$243.00   $170.00
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  • Technical Information
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Technical Information
Catalog Number:
AA003I85
Chemical Name:
3-(Trifluoromethyl)phenethyl alcohol
CAS Number:
455-01-6
Molecular Formula:
C9H9F3O
Molecular Weight:
190.1624
MDL Number:
MFCD00009710
IUPAC Name:
2-[3-(trifluoromethyl)phenyl]ethanol
InChI:
InChI=1S/C9H9F3O/c10-9(11,12)8-3-1-2-7(6-8)4-5-13/h1-3,6,13H,4-5H2
InChI Key:
YDKIPCCKZKQMDT-UHFFFAOYSA-N
SMILES:
OCCc1cccc(c1)C(F)(F)F
EC Number:
207-233-9
NSC Number:
43028
Properties
Computed Properties
 
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.061g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.165g/mol
Monoisotopic Mass:
190.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
455-01-6 
2-(3-(Trifluoromethyl)phenyl)ethanol 
2-[m-(Trifluoromethyl)phenyl]ethanol 
Phenethyl alcohol, m-(trifluoromethyl)- 
NSC43028 
EINECS 207-233-9 
ACMC-1ARQP 
AC1L3VE9 
AC1Q4JT8 
AC1Q7CJ2 
SCHEMBL156739 
CTK4I8841 
3-(Trifluoromethyl)phenethyl alcohol 
3-(Trifluoromethyl)benzeneethanol 
3-trifluoromethylphenethyl alcohol 
DTXSID20196530 
KS-00000NC0 
ZINC1675813 
Benzeneethanol,3-(trifluoromethyl)- 
ANW-71659 
CK1133 
MFCD00009710 
NSC-43028 
2-[3-(Trifluoromethyl)phenyl]ethanol 
2-(3-trifluoromethyl-phenyl)-ethanol 
AKOS005216609 
2-(3-(trifluoromethyl)-phenyl)ethanol 
AS00591 
CM13513 
MCULE-9196778199 
NE10671 
AJ-29404 
AK-77078 
AS-19450 
Benzeneethanol, 3-(trifluoromethyl)- 
SC-58208 
3-(Trifluoromethyl)phenethyl alcohol, 99% 
AB0034191 
TC-160404 
CS-0042766 
ST50405647 
X8303 
EN300-73284 
I14-49433 
Z1262237342 
2-[3-(trifluoromethyl)phenyl]ethan-1-ol 
C9-H9-F3-O 
CID95926 
AR-1H8558 
3-(Trifluoromethyl)phenethyl alcohol, 99% - 1G 1g 
488-93-7 
C9H9F3O 
3-(Trifluoromethyl)phenethylic alcohol 
YDKIPCCKZKQMDT-UHFFFAOYSA-N 
m-(Trifluoromethyl)phenethyl alcohol 
Literature
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