1,3-Bis(ethenylsulfonyl)-2-propanol

C₇H₁₂O₅S₂CAS 67006-32-0240.29 g/mol

Open in Covalent MOL file

Alcohol Alkene Sulfone

Properties

Molecular formula: C₇H₁₂O₅S₂
Molar mass: 240.29 g/mol
Exact mass: 240.0126 Da
logP: -0.54Crippen estimate
Polar surface area: 88.5 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 6

Hazards

Danger

H301 Toxic if swallowed100% of notifiers
H317 May cause an allergic skin reaction100% of notifiers
H318 Causes serious eye damage100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P280, P301+P316, P302+P352, P305+P354+P338, P317, P321, P330, P333+P317, P362+P364, P405, P501

Identifiers

CAS number

67006-32-0

SMILES

C=CS(=O)(=O)CC(O)CS(=O)(=O)C=C

InChIKey

SOBDFTUDYRPGJY-UHFFFAOYSA-N

InChI

InChI=1S/C7H12O5S2/c1-3-13(9,10)5-7(8)6-14(11,12)4-2/h3-4,7-8H,1-2,5-6H2

Weigh it out

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

Names and synonyms

4 names

2-Propanol, 1,3-bis(ethenylsulfonyl)-
1,3-Bis(vinylsulfonyl)-2-propanol
1,3-Divinylsulfonyl-2-hydroxypropane
1,3-Bis(vinylsulfonyl)-2-hydroxypropane

Work with 1,3-Bis(ethenylsulfonyl)-2-propanol

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

1,1′-[Methylenebis(sulfonyl)]bis[ethene]3278-22-650 % similar (Ethylsulfonyl)ethene1889-59-444 % similar 1,3-Bis[(2-chloroethyl)sulfonyl]-2-propanol67006-35-334 % similar 1,6-Heptadien-4-ol2883-45-633 % similar Divinyl sulfone77-77-032 % similar Sodium 3-allyloxy-2-hydroxy-1-propanesulfonate52556-42-031 % similar Sodium vinylsulfonate3039-83-630 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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