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119346-71-3 | 2-Propenoic acid, 2-chloro-3-(4-fluorophenyl)-, ethyl ester, (2Z)-
CAS No: 119346-71-3 Catalog No: AG000IMW MDL No:
Product Description
Catalog Number:
AG000IMW
Chemical Name:
2-Propenoic acid, 2-chloro-3-(4-fluorophenyl)-, ethyl ester, (2Z)-
CAS Number:
119346-71-3
Molecular Formula:
C11H10ClFO2
Molecular Weight:
228.6473
IUPAC Name:
ethyl 2-chloro-3-(4-fluorophenyl)prop-2-enoate
InChI:
InChI=1S/C11H10ClFO2/c1-2-15-11(14)10(12)7-8-3-5-9(13)6-4-8/h3-7H,2H2,1H3
InChI Key:
UUOIWRCRWOTLBU-UHFFFAOYSA-N
SMILES:
CCOC(=O)/C(=C/c1ccc(cc1)F)/Cl
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.035g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.647g/mol
Monoisotopic Mass:
228.035g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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