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Home > Fluorides > 142038-16-2
142038-16-2 | 2-Butanone, 4-[(4-fluorophenyl)thio]-
CAS No: 142038-16-2 Catalog No: AG001HLS MDL No:MFCD08691520
Product Description
Catalog Number:
AG001HLS
Chemical Name:
2-Butanone, 4-[(4-fluorophenyl)thio]-
CAS Number:
142038-16-2
Molecular Formula:
C10H11FOS
Molecular Weight:
198.2571
MDL Number:
MFCD08691520
IUPAC Name:
4-(4-fluorophenyl)sulfanylbutan-2-one
InChI:
InChI=1S/C10H11FOS/c1-8(12)6-7-13-10-4-2-9(11)3-5-10/h2-5H,6-7H2,1H3
InChI Key:
OBEQFWIFNCWDBF-UHFFFAOYSA-N
SMILES:
CC(=O)CCSc1ccc(cc1)F
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.051g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.255g/mol
Monoisotopic Mass:
198.051g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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