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138506-00-0 | 2-Propenoic acid, 2-methyl-, 3,3,4,4-tetrafluorobutyl ester
CAS No: 138506-00-0 Catalog No: AG0019B5 MDL No:
Product Description
Catalog Number:
AG0019B5
Chemical Name:
2-Propenoic acid, 2-methyl-, 3,3,4,4-tetrafluorobutyl ester
CAS Number:
138506-00-0
Molecular Formula:
C8H10F4O2
Molecular Weight:
214.1574
IUPAC Name:
3,3,4,4-tetrafluorobutyl 2-methylprop-2-enoate
InChI:
InChI=1S/C8H10F4O2/c1-5(2)6(13)14-4-3-8(11,12)7(9)10/h7H,1,3-4H2,2H3
InChI Key:
XZPZCHSPDJPFSV-UHFFFAOYSA-N
SMILES:
FC(C(CCOC(=O)C(=C)C)(F)F)F
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.062g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.16g/mol
Monoisotopic Mass:
214.062g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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