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13057-08-4

13057-08-4 | 2-Propenoic acid, 1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester

CAS No: 13057-08-4 Catalog No: AG000UNJ MDL No:MFCD00274356

Product Description

Catalog Number:
AG000UNJ
Chemical Name:
2-Propenoic acid, 1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl ester
CAS Number:
13057-08-4
Molecular Formula:
C6H3F7O2
Molecular Weight:
240.0756
MDL Number:
MFCD00274356
IUPAC Name:
1,1,1,2,3,3,3-heptafluoropropan-2-yl prop-2-enoate
InChI:
InChI=1S/C6H3F7O2/c1-2-3(14)15-4(7,5(8,9)10)6(11,12)13/h2H,1H2
InChI Key:
JTCVKNUSIGHJRG-UHFFFAOYSA-N
SMILES:
C=CC(=O)OC(C(F)(F)F)(C(F)(F)F)F
EC Number:
235-943-9

Properties

Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.002g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.077g/mol
Monoisotopic Mass:
240.002g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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