Home Carboxys methyl 2-(trifluoromethyl)-3,6-dihydro-2H-pyran-2-carboxylate

methyl 2-(trifluoromethyl)-3,6-dihydro-2H-pyran-2-carboxylate

CAS No.:
134224-62-7
Catalog Number:
AG01EM53
Molecular Formula:
C8H9F3O3
Molecular Weight:
210.1505
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Product Description
Catalog Number:
AG01EM53
Chemical Name:
methyl 2-(trifluoromethyl)-3,6-dihydro-2H-pyran-2-carboxylate
CAS Number:
134224-62-7
Molecular Formula:
C8H9F3O3
Molecular Weight:
210.1505
MDL Number:
MFCD05856928
IUPAC Name:
methyl 6-(trifluoromethyl)-2,5-dihydropyran-6-carboxylate
InChI:
InChI=1S/C8H9F3O3/c1-13-6(12)7(8(9,10)11)4-2-3-5-14-7/h2-3H,4-5H2,1H3
InChI Key:
PWRVOHRDESZIIS-UHFFFAOYSA-N
SMILES:
COC(=O)C1(OCC=CC1)C(F)(F)F
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.05g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.152g/mol
Monoisotopic Mass:
210.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties