chempirical

Methionol

C4H10OSCAS 505-10-2106.18 g/mol

Open in Covalent MOL file
SOH
AlcoholSulfide

Properties

Molecular formula
C4H10OS
Molar mass
106.18 g/mol
Exact mass
106.0452 Da
Density
1.03 g/mL (at 20 °C)
Boiling point
102 °C (at 14 Torr)
logP
0.73Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 168 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
505-10-2
SMILES
CSCCCO
InChIKey
CZUGFKJYCPYHHV-UHFFFAOYSA-N
InChI
InChI=1S/C4H10OS/c1-6-4-2-3-5/h5H,2-4H2,1H3

Weigh it out

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

Names and synonyms

9 names
  • 1-Propanol, 3-(methylthio)-
  • 3-(Methylthio)-1-propanol
  • γ-Methylmercaptopropyl alcohol
  • 3-Methylmercapto-1-propanol
  • 3-Hydroxypropyl methyl sulfide
  • 3-(Methylthio)propanol
  • 4-Thiapentan-1-ol
  • 3-(Methylsulfanyl)-1-propanol
  • NSC 2859

Work with Methionol

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

2-(Methylthio)ethanol5271-38-567 % similar Butyl methyl sulfide628-29-548 % similar 3-(Methylthio)propylamine4104-45-445 % similar 1-(Methylthio)dodecane3698-89-343 % similar 1,4-Butanediol110-63-441 % similar Polytetrahydrofuran25190-06-141 % similar 1,3-Propanediol504-63-241 % similar 1,5-Pentanediol111-29-539 % similar

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

Same formula

2-(Ethylthio)ethanol110-77-0 Rel-(2R,3S)-3-Mercapto-2-butanol37887-04-0 3-Mercapto-2-butanol54812-86-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia