Methyl propyl trisulfide

C₄H₁₀S₃CAS 17619-36-2154.30 g/mol

Open in Covalent MOL file

Disulfide

Properties

Molecular formula: C₄H₁₀S₃
Molar mass: 154.30 g/mol
Exact mass: 153.9945 Da
Density: 1.095–1.101 g/mL
logP: 3.06Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 4

Hazards

Warning

H302 Harmful if swallowed94.7% of notifiers
H315 Causes skin irritation10.7% of notifiers
H319 Causes serious eye irritation10.7% of notifiers
H335 May cause respiratory irritation10.7% of notifiers

Aggregated from 1,441 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

17619-36-2

SMILES

CCCSSSC

InChIKey

ZOYASYRPGHCQHW-UHFFFAOYSA-N

InChI

InChI=1S/C4H10S3/c1-3-4-6-7-5-2/h3-4H2,1-2H3

Weigh it out

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

Names and synonyms

2 names

Trisulfide, methyl propyl
1-Methyl-3-propyltrisulfane

Work with Methyl propyl trisulfide

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 propyl disulfide2179-60-468 % similar Dipropyl trisulfide6028-61-167 % similar Dipropyl disulfide629-19-656 % similar Methyl propyl sulphide3877-15-443 % similar Propyl sulfide111-47-740 % similar Dimethyl trisulfide3658-80-839 % similar Methylallyl trisulfide34135-85-838 % similar Allyl propyl disulfide2179-59-137 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Mercaptoethyl sulfide3570-55-6 Diethyl trisulfide3600-24-6

Elsewhere

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