BENZOIC ACID, m-THIOCYANO-

Base Information

Chemical Name:BENZOIC ACID, m-THIOCYANO-
CAS No.:16671-87-7
Molecular Formula:C₈H₅NO₂S
Molecular Weight:179.199
Hs Code.:2930909090
DSSTox Substance ID:DTXSID50168164
Nikkaji Number:J42.027A
Wikidata:Q83037691
Mol file:16671-87-7.mol

Synonyms:3-thiocyanatobenzoic acid;BENZOIC ACID, m-THIOCYANO-;m-Thiocyanobenzoic acid;16671-87-7;Kyselina m-thiokyanatobenzoova [Czech];BRN 3247509;Kyselina m-thiokyanatobenzoova;3-10-00-00270 (Beilstein Handbook Reference);3-Thiocyanobenzoic acid;Benzoic acid, m-thiocyanato-;Benzoic acid, 3-thiocyanato-;SCHEMBL7046156;DTXSID50168164;LS-38329

Suppliers and Price of BENZOIC ACID, m-THIOCYANO-

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

Total 4 raw suppliers

Chemical Property of BENZOIC ACID, m-THIOCYANO-

Chemical Property:

Vapor Pressure:3.66E-06mmHg at 25°C
Melting Point:177-179 °C (decomp)
Boiling Point:371.1°Cat760mmHg
PKA:3.69±0.10(Predicted)
Flash Point:178.2°C
PSA：86.39000
Density:1.43g/cm³
LogP:1.95798
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:179.00409958
Heavy Atom Count:12
Complexity:220

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)SC#N)C(=O)O

Technology Process of BENZOIC ACID, m-THIOCYANO-

There total 1 articles about BENZOIC ACID, m-THIOCYANO- 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: