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89760-42-9 | 2-Propenoic acid, 3-(2-fluorophenyl)-, ethyl ester, (E)-
CAS No: 89760-42-9 Catalog No: AG0040TE MDL No:MFCD03095007
Product Description
Catalog Number:
AG0040TE
Chemical Name:
2-Propenoic acid, 3-(2-fluorophenyl)-, ethyl ester, (E)-
CAS Number:
89760-42-9
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
MDL Number:
MFCD03095007
IUPAC Name:
ethyl (E)-3-(2-fluorophenyl)prop-2-enoate
InChI:
InChI=1S/C11H11FO2/c1-2-14-11(13)8-7-9-5-3-4-6-10(9)12/h3-8H,2H2,1H3/b8-7+
InChI Key:
YOIVHDQJCFLRRB-BQYQJAHWSA-N
SMILES:
CCOC(=O)/C=C/c1ccccc1F
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
194.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.205g/mol
Monoisotopic Mass:
194.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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