Diiodomethyl P-tolyl sulfone

C₈H₈I₂O₂SCAS 20018-09-1422.02 g/mol

Open in Covalent MOL file

Alkyl halide Sulfone

Properties

Molecular formula: C₈H₈I₂O₂S
Molar mass: 422.02 g/mol
Exact mass: 421.8334 Da
logP: 2.92Crippen estimate
Polar surface area: 34.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

20018-09-1

SMILES

Cc1ccc(S(=O)(=O)C(I)I)cc1

InChIKey

XOILGBPDXMVFIP-UHFFFAOYSA-N

InChI

InChI=1S/C8H8I2O2S/c1-6-2-4-7(5-3-6)13(11,12)8(9)10/h2-5,8H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

29 names · show all

Benzene, 1-[(diiodomethyl)sulfonyl]-4-methyl-
Sulfone, diiodomethyl p-tolyl
1-[(Diiodomethyl)sulfonyl]-4-methylbenzene
4-Tolyl diiodomethyl sulfone
Amical 48
p-Methylphenyl diiodomethyl sulfone
p-Tolyl diiodomethyl sulfone
Diiodomethyl 4-tolyl sulfone
ABG 2000
DP 1104
Amical 50
Amical 81
A 9248
Amical WP
Ultra-fresh UF 95
Yotoru D
Ultra-fresh 95
p-[(Diiodomethyl)sulfonyl]toluol
Surfasept 74859
Ultra-fresh DM 95
DM 95
Amical flowable
Microban additive AF
Mil-kil
Ultra-fresh 15
Hokucide AM-48
Yohtol DP 95
1-Diiodomethanesulfonyl-4-methylbenzene
PBM-OK

Work with Diiodomethyl P-tolyl sulfone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl P-tolyl sulfone3185-99-747 % similar P-Toluenesulfonic acid104-15-445 % similar P-Toluenesulfonic anhydride4124-41-845 % similar 4-Methylbenzenesulfonyl fluoride455-16-345 % similar P-Toluenesulfonamide70-55-345 % similar 4-Toluenesulfonyl chloride98-59-945 % similar Sodium 4-methylbenzenesulfonate12068-03-042 % similar N-Methyl-P-toluenesulfonamide640-61-942 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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