Home Fluorides 1221723-74-5
1221723-74-5,MFCD15209708
Catalog No.:AA01A8AM
1221723-74-5 | 2,2,2-Trifluoroethyl n-(3-acetylphenyl)carbamate
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$306.00   $214.00
- +
500mg
95.0%
3 weeks  
$540.00   $378.00
- +
1g
95.0%
3 weeks  
$775.00   $542.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA01A8AM
Chemical Name:
2,2,2-Trifluoroethyl n-(3-acetylphenyl)carbamate
CAS Number:
1221723-74-5
Molecular Formula:
C11H10F3NO3
Molecular Weight:
261.1972
MDL Number:
MFCD15209708
IUPAC Name:
2,2,2-trifluoroethyl N-(3-acetylphenyl)carbamate
InChI:
InChI=1S/C11H10F3NO3/c1-7(16)8-3-2-4-9(5-8)15-10(17)18-6-11(12,13)14/h2-5H,6H2,1H3,(H,15,17)
InChI Key:
XXAHZDAIWGQECU-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccc(c1)C(=O)C)OCC(F)(F)F
Properties
Computed Properties
 
Complexity:
317  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.061g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
261.2g/mol
Monoisotopic Mass:
261.061g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Synonyms
 
2,2,2-trifluoroethyl N-(3-acetylphenyl)carbamate 
1221723-74-5 
AC1Q1JMX 
CTK7G6714 
ZINC47843921 
AKOS011495513 
MCULE-3014970527 
NE15887 
EN300-61367 
Z992717142 
Literature
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