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Home > Fluorides > 227939-15-3
227939-15-3 | 2-Propenoic acid, 3-(4-ethoxy-3-fluorophenyl)-, ethyl ester, (2E)-
CAS No: 227939-15-3 Catalog No: AG01EUKE MDL No:
Product Description
Catalog Number:
AG01EUKE
Chemical Name:
2-Propenoic acid, 3-(4-ethoxy-3-fluorophenyl)-, ethyl ester, (2E)-
CAS Number:
227939-15-3
Molecular Formula:
C13H15FO3
Molecular Weight:
238.2548
IUPAC Name:
ethyl (E)-3-(4-ethoxy-3-fluorophenyl)prop-2-enoate
InChI:
InChI=1S/C13H15FO3/c1-3-16-12-7-5-10(9-11(12)14)6-8-13(15)17-4-2/h5-9H,3-4H2,1-2H3/b8-6+
InChI Key:
BTNLVYNQXRYOSG-SOFGYWHQSA-N
SMILES:
CCOC(=O)/C=C/c1ccc(c(c1)F)OCC
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
238.101g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.258g/mol
Monoisotopic Mass:
238.101g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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