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Home > Fluorides > 188941-01-7
188941-01-7 | 2-Propenoic acid, 2-fluoro-3-(4-methylphenyl)-, methyl ester
CAS No: 188941-01-7 Catalog No: AG002HKE MDL No:
Product Description
Catalog Number:
AG002HKE
Chemical Name:
2-Propenoic acid, 2-fluoro-3-(4-methylphenyl)-, methyl ester
CAS Number:
188941-01-7
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
IUPAC Name:
methyl 2-fluoro-3-(4-methylphenyl)prop-2-enoate
InChI:
InChI=1S/C11H11FO2/c1-8-3-5-9(6-4-8)7-10(12)11(13)14-2/h3-7H,1-2H3
InChI Key:
BBQNKWURAYBNIL-UHFFFAOYSA-N
SMILES:
COC(=O)C(=Cc1ccc(cc1)C)F
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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