71915
Sodium 1-propanethiolate
technical, ≥95% (RT)
Synonym(s):
1-Propanethiol sodium salt
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About This Item
Linear Formula:
CH3CH2CH2SNa
CAS Number:
Molecular Weight:
98.14
EC Number:
230-005-5
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
3556024
MDL number:
Assay:
≥95% (RT)
Form:
crystals
InChI key
XVSFHIIADLZQJP-UHFFFAOYSA-M
InChI
1S/C3H8S.Na/c1-2-3-4;/h4H,2-3H2,1H3;/q;+1/p-1
SMILES string
CCCS[Na]
grade
technical
assay
≥95% (RT)
form
crystals
Quality Level
Other Notes
Salts of alkanethiols are versatile intermediates for the synthesis of various thiol esters and thio ethers. In contrast to the stenchy gaseous or liquid thiols, the salts are easy to handle solids.; Alkanethiolates are strong nucleophiles and thus efficient reagents for SN2 type dealkylations of hindered esters and lactones; Dealkylation of aryl methyl ethers
signalword
Danger
hcodes
Hazard Classifications
Skin Corr. 1B
Storage Class
8A - Combustible corrosive hazardous materials
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
Regulatory Information
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P.A. Bartlett et al.
Tetrahedron Letters, 4459-4459 (1970)
L. Testaferri et al.
Synthesis, 751-751 (1983)
G.I. Feutrill et al.
Tetrahedron Letters, 1327-1327 (1970)
W.R. Vaughan et al.
The Journal of Organic Chemistry, 27, 739-739 (1962)
Noelia B Luque et al.
Langmuir : the ACS journal of surfaces and colloids, 27(23), 14514-14521 (2011-10-06)
Periodic density functional calculations have been carried out to investigate both the thiol adsorption on Au(111) surface and the reaction mechanism for the formation of the self-assembled monolayers, taking propanethiol as a representative example. The effect of coverage and surface
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