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88653-63-8 | Sulfonium, (1,1-dimethyl-2-oxo-2-phenylethyl)dimethyl-, bromide
CAS No: 88653-63-8 Catalog No: AG0048XM MDL No:
Product Description
Catalog Number:
AG0048XM
Chemical Name:
Sulfonium, (1,1-dimethyl-2-oxo-2-phenylethyl)dimethyl-, bromide
CAS Number:
88653-63-8
Molecular Formula:
C12H17BrOS
Molecular Weight:
289.2318
IUPAC Name:
dimethyl-(2-methyl-1-oxo-1-phenylpropan-2-yl)sulfanium;bromide
InChI:
InChI=1S/C12H17OS.BrH/c1-12(2,14(3)4)11(13)10-8-6-5-7-9-10;/h5-9H,1-4H3;1H/q+1;/p-1
InChI Key:
GIFGXAXGRCXPAW-UHFFFAOYSA-M
SMILES:
O=C(C([S+](C)C)(C)C)c1ccccc1.[Br-]
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.018g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.231g/mol
Monoisotopic Mass:
288.018g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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