2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride

Base Information Edit

Chemical Name:2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride
CAS No.:22816-60-0
Molecular Formula:C8H9Cl3N2S
Molecular Weight:271.598
Hs Code.:2930909090
European Community (EC) Number:803-561-7
NSC Number:68664,28121,23474
DSSTox Substance ID:DTXSID20385285
Wikipedia:A22_(antibiotic)
Wikidata:Q279935
ChEMBL ID:CHEMBL1224484
Mol file:22816-60-0.mol

Synonyms:22816-60-0;MreB Perturbing Compound A22;2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride;A22 hydrochloride;A22 (hydrochloride);MreB Perturbing Compound A22 (hydrochloride);S-(3,4-Dichlorobenzyl)isothiourea hydrochloride;NSC 23474;NSC 28121;NSC 68664;(3,4-dichlorophenyl)methyl carbamimidothioate;hydrochloride;2-(3,4-DICHLORO-BENZYL)-ISOTHIOUREA;HYDROCHLORIDE;22816-60-0 (HCl);3,4-dichlorobenzyl carbamimidothioate hydrochloride;{[(3,4-dichlorophenyl)methyl]sulfanyl}methanimidamide hydrochloride;CHEMBL1224484;amino[(3,4-dichlorobenzyl)sulfanyl]methaniminium chloride;(Amino((3,4-dichlorobenzyl)thio)methylidene)ammonium chloride;A 22 hydrochloride;MreB inhibitor A22;D0P1CO;2-[(3,4-dichlorophenyl)methyl]isothiourea hydrochloride;DTXSID20385285;GLXC-25128;Amino[sulfanyl]methaniminiumchloride;NSC23474;NSC28121;NSC68664;XAA81660;NSC-23474;NSC-28121;NSC-68664;AKOS015845844;A22 hydrochloride, >=95% (HPLC);S-(3,4-Dichlorobenzyl)Isothiourea HCl;CS-10293;2-(3,4-Dichloro-benzyl)-isothiourea HCl;HY-118773;CS-0068487;FT-0755129;2-(3,4-Dichlorobenzyl)isothiourea hydrochloride;EN300-1692885;10P-080;Q279935;J-014869;Z48820353;Carbamimidothioic acid, (3,4-dichlorophenyl)methyl ester, hydrochloride (1:1)

Suppliers and Price of 2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride

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
MreB Perturbing Compound A22
250mg
$ 495.00

TRC
MreB Perturbing Compound A22
25mg
$ 85.00

Sigma-Aldrich
MreB Perturbing Compound A22
25mg
$ 129.50

Sigma-Aldrich
A22 hydrochloride ≥95% (HPLC)
10mg
$ 79.20

Sigma-Aldrich
A22 hydrochloride ≥95% (HPLC)
50mg
$ 323.00

Matrix Scientific
2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride 95+%
1g
$ 174.00

Matrix Scientific
2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride 95+%
5g
$ 696.00

Crysdot
2-(3,4-Dichlorobenzyl)isothiouroniumchloride 97%
5g
$ 508.00

Cayman Chemical
MreB Perturbing Compound A22 ≥95%
50mg
$ 177.00

Cayman Chemical
MreB Perturbing Compound A22 ≥95%
10mg
$ 59.00

Total 13 raw suppliers

Chemical Property of 2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride Edit

Chemical Property:

Vapor Pressure:5.3E-05mmHg at 25°C
Melting Point:210 °C
Refractive Index:1.643
Boiling Point:347.7 °C at 760 mmHg
Flash Point:164.1 °C
PSA：75.17000
Density:1.47 g/cm³
LogP:4.72210
Storage Temp.:2-8°C
Solubility.:H2O: soluble2mg/mL (clear solution, warmed)
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:269.955203
Heavy Atom Count:14
Complexity:189

Purity/Quality:

98%,99%, ^*data from raw suppliers

MreB Perturbing Compound A22 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=C(C=C1CSC(=N)N)Cl)Cl.Cl
Uses MreB Perturbing Compound A22 is an isothiourea that reversibly perturbs MreB function.

Technology Process of 2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride

There total 2 articles about 2-(3,4-Dichloro-benzyl)-isothiourea hydrochloride 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: 88.0%