Home Other Building Blocks methyl 3-(4-fluorophenyl)but-2-enoate

methyl 3-(4-fluorophenyl)but-2-enoate

CAS No.:
1563216-58-9
Catalog Number:
AG01AD7E
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
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Product Description
Catalog Number:
AG01AD7E
Chemical Name:
methyl 3-(4-fluorophenyl)but-2-enoate
CAS Number:
1563216-58-9
Molecular Formula:
C11H11FO2
Molecular Weight:
194.2022
MDL Number:
MFCD29041026
IUPAC Name:
methyl 3-(4-fluorophenyl)but-2-enoate
InChI:
InChI=1S/C11H11FO2/c1-8(7-11(13)14-2)9-3-5-10(12)6-4-9/h3-7H,1-2H3
InChI Key:
GNJGRAWNPUCVSX-UHFFFAOYSA-N
SMILES:
COC(=O)C=C(c1ccc(cc1)F)C
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  
Properties