{[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

Base Information

Chemical Name:{[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid
CAS No.:30452-55-2
Molecular Formula:C₈H₇N₃O₃S
Molecular Weight:225.228
Hs Code.:2934999090
NSC Number:634485
DSSTox Substance ID:DTXSID301200785
ChEMBL ID:CHEMBL1985121
Mol file:30452-55-2.mol

Synonyms:30452-55-2;{[5-(2-furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid;NSC634485;2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid;(5-Furan-2-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid;2-[[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid;{[5-(2-furyl)-4H-1,2,4-triazol-3-yl]thio}acetic acid;([5-(2-furyl)-4h-1,2,4-triazol-3-yl]thio)acetic acid;CHEMBL1985121;DTXSID301200785;MFCD02366325;STK927296;AKOS005640797;NSC-634485;SB61480;NCI60_011468;EU-0009079;VU0060976-1;SR-01000081944;SR-01000081944-1;((5-(2-Furyl)-1H-1,2,4-triazol-3-yl)thio)acetic acid;{[3-(2-furyl)-1H-1,2,4-triazol-5-yl]thio}acetic acid;(5-Furan-2-yl-4H-[1,2,4]triazol-3-ylsulfanyl)acetic acid;2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)aceticacid;2-[[3-(2-Furanyl)-1H-1,2,4-triazol-5-yl]thio]acetic acid;{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid;2-([5-(furan-2-yl)-4h-1,2,4-triazol-3-yl]sulfanyl)acetic acid;(5-Furan-2-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid, AldrichCPR

Suppliers and Price of {[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

Supply Marketing:

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
{[5-(2-furyl)-4H-1,2,4-triazol-3-yl]thio}aceticAcid
50mg
$ 60.00

Crysdot
2-((5-(Furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)aceticacid 95+%
1g
$ 316.00

American Custom Chemicals Corporation
((5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID 95.00%
5G
$ 1138.78

American Custom Chemicals Corporation
((5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID 95.00%
1G
$ 721.59

Total 5 raw suppliers

Chemical Property of {[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

Chemical Property:

Vapor Pressure:9.97E-12mmHg at 25°C
Boiling Point:522.1°C at 760 mmHg
Flash Point:269.6°C
PSA：117.31000
Density:1.61g/cm³
LogP:1.24140
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:225.02081227
Heavy Atom Count:15
Complexity:241

Purity/Quality:

99% ^*data from raw suppliers

{[5-(2-furyl)-4H-1,2,4-triazol-3-yl]thio}aceticAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=COC(=C1)C2=NC(=NN2)SCC(=O)O

Technology Process of {[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

There total 2 articles about {[5-(2-Furyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid 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:

: 30452-53-0
(5-furan-2-yl-1H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid ethyl ester

: 30452-55-2
(5-furan-2-yl-1H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid

Guidance literature:: With sodium hydroxide; Ambient temperature;
DOI:10.1016/S0040-4020(01)98732-0

Reference yield:

: 35771-65-4
3-(furan-2-yl)-1H-1,2,4-triazole-5-thiol

: 30452-55-2
(5-furan-2-yl-1H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: (i) aq. NaHCO₃, (ii) /BRN= 506456/, EtOH

2: aq. NaOH / Ambient temperature

With sodium hydroxide;
DOI:10.1016/S0040-4020(01)98732-0