Allyl mercaptan

Base Information Edit

Chemical Name:Allyl mercaptan
CAS No.:870-23-5
Molecular Formula:C3H6S
Molecular Weight:74.1466
Hs Code.:29309090
European Community (EC) Number:212-792-7
NSC Number:6744
UNII:1X587IBY09
DSSTox Substance ID:DTXSID2061226
Nikkaji Number:J1.740J
Wikipedia:Allyl_mercaptan
Wikidata:Q25104273
NCI Thesaurus Code:C68522
Metabolomics Workbench ID:45006
ChEMBL ID:CHEMBL3222024
Mol file:870-23-5.mol

Synonyms:ALLYL MERCAPTAN;2-Propene-1-thiol;870-23-5;prop-2-ene-1-thiol;Allylthiol;Allyl sulfhydrate;FEMA No. 2035;2-Propenyl mercaptan;2-Propenyl-1-thiol;CH2=CHCH2SH;UNII-1X587IBY09;Allylmercaptan;CHEBI:89888;1X587IBY09;NSC 6744;NSC-6744;EINECS 212-792-7;AI3-23286;allyl thiol;allyl thioalcohol;3-Mercaptopropene;MFCD00004894;Allyl mercaptan, >=70%;Allyl mercaptan, >=90%;1-PROPENE-3-THIOL;ALLYL MERCAPTAN [FHFI];CHEMBL3222024;DTXSID2061226;FEMA 2035;ULIKDJVNUXNQHS-UHFFFAOYSA-;NSC6744;AKOS000120943;A0777;FT-0622029;2-Propene-1-thiol, technical, ~60% (GC);D88323;A841917;Q25104273

Suppliers and Price of Allyl mercaptan

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
AllylMercaptan(>75%)
2.5g
$ 70.00

TCI Chemical
Allyl Mercaptan >80.0%(GC)
25mL
$ 73.00

Sigma-Aldrich
2-Propene-1-thiol technical, ~60% (GC)
25ml
$ 119.00

Sigma-Aldrich
Allyl mercaptan ≥90%
1 SAMPLE
$ 50.00

Sigma-Aldrich
Allyl mercaptan ≥90%
sample
$ 50.00

Sigma-Aldrich
Allyl mercaptan ≥90%
100g
$ 500.00

Sigma-Aldrich
2-Propene-1-thiol technical, ~60% (GC)
100ml
$ 451.00

Sigma-Aldrich
Allyl mercaptan ≥90%
500g
$ 2300.00

American Custom Chemicals Corporation
ALLYL MERCAPTAN 95.00%
100ML
$ 2710.79

American Custom Chemicals Corporation
ALLYL MERCAPTAN 95.00%
25ML
$ 1165.97

Total 49 raw suppliers

Chemical Property of Allyl mercaptan Edit

Chemical Property:

Appearance/Colour:colourless to faintly yellow-brown liquid
Vapor Pressure:152mmHg at 25°C
Melting Point:175-176 °C(Solv: benzene (71-43-2))
Refractive Index:n20/D 1.4765(lit.)
Boiling Point:68.4 °C at 760 mmHg
PKA:9.83±0.10(Predicted)
Flash Point:21.1 °C
PSA：38.80000
Density:0.85 g/cm³
LogP:1.10220
Storage Temp.:−20°C
Sensitive.:Air Sensitive
Solubility.:Not miscible or difficult to mix.
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:74.01902136
Heavy Atom Count:4
Complexity:17.2

Purity/Quality:

99% ^*data from raw suppliers

AllylMercaptan(>75%) ^*data from reagent suppliers

Safty Information:

Pictogram(s): F
Hazard Codes:F
Statements: 11
Safety Statements: 16-33-9

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Other Classes -> Sulfur Compounds
Canonical SMILES:C=CCS
Uses Allyl mercaptan is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields. Allyl Mercaptan is a synthetic flavoring agent that is a stable, color- less liquid of garlic-like odor. it should be stored in glass or tin con- tainers. it is used in artificial garlic flavors for application in condiments at 3 ppm, and in baked goods at 2 ppm. it is also termed 2 propylene-1 thiol.

Technology Process of Allyl mercaptan

There total 34 articles about Allyl mercaptan which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 95.0%

: 2179-57-9
diallyl disulphide

: 870-23-5
prop-2-ene-1-thiol

Guidance literature:: With indium; ammonium chloride; In ethanol; for 1h; Heating;

Reference yield: 94.19%

: 107-05-1
3-chloroprop-1-ene

: 870-23-5
prop-2-ene-1-thiol

Guidance literature:: With sodium hydrogen sulfide monohydrate; diallyl disulphide; N-benzyl-N,N,N-triethylammonium chloride; In water; xylene; at -2 - 40 ℃; for 10h; Product distribution / selectivity; Inert atmosphere;