Home Other Building Blocks 1-(4-fluorophenyl)-3-methylbut-2-en-1-one

1-(4-fluorophenyl)-3-methylbut-2-en-1-one

CAS No.:
92236-75-4
Catalog Number:
AG01C6M0
Molecular Formula:
C11H11FO
Molecular Weight:
178.2028
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Product Description
Catalog Number:
AG01C6M0
Chemical Name:
1-(4-fluorophenyl)-3-methylbut-2-en-1-one
CAS Number:
92236-75-4
Molecular Formula:
C11H11FO
Molecular Weight:
178.2028
MDL Number:
MFCD21818220
IUPAC Name:
1-(4-fluorophenyl)-3-methylbut-2-en-1-one
InChI:
InChI=1S/C11H11FO/c1-8(2)7-11(13)9-3-5-10(12)6-4-9/h3-7H,1-2H3
InChI Key:
FFMUQNCYEDRADF-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)F)C=C(C)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.206g/mol
Monoisotopic Mass:
178.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties