alpha-Phenyl-p-tolyl isocyanate

Base Information

Chemical Name:alpha-Phenyl-p-tolyl isocyanate
CAS No.:1823-37-6
Molecular Formula:C14H11 N O
Molecular Weight:209.247
Hs Code.:2929109000
European Community (EC) Number:625-493-5
DSSTox Substance ID:DTXSID60171280
Nikkaji Number:J2.941.600A
Wikidata:Q27124220
Metabolomics Workbench ID:58769
Mol file:1823-37-6.mol

Synonyms:1-benzyl-4-isocyanatobenzene;1823-37-6;alpha-Phenyl-p-tolyl isocyanate;4-Benzylphenyl isocyanate;4-isocyanatodiphenylmethane;Isocyanic acid, alpha-phenyl-p-tolyl ester;4-isocyanato-4'-diphenylmethane;diphenylmethane monoisocyanate;CHEBI:55312;IDM;MMI;4'-Benzylphenyl isocyanate;alpha-phenyl-p-tolyl ester;Epitope ID:120374;SCHEMBL510929;4,4'-isocyanatodiphenylmethane;4-Benzylphenyl isocyanate, 97%;DTXSID60171280;1-isocyanato-4-(phenylmethyl)benzene;AKOS015889256;4-BENZYLPHENYL ISOCYANATE 97;A800436;J-011665;Q27124220

Suppliers and Price of alpha-Phenyl-p-tolyl isocyanate

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

American Custom Chemicals Corporation
4-BENZYLPHENYL ISOCYANATE 95.00%
1G
$ 667.62

Sigma-Aldrich
4-Benzylphenyl isocyanate 97%
1g
$ 64.70

TRC
4-Benzylphenyl isocyanate
100mg
$ 65.00

Total 11 raw suppliers

Chemical Property of alpha-Phenyl-p-tolyl isocyanate

Chemical Property:

Vapor Pressure:0.000378mmHg at 25°C
Refractive Index:n20/D 1.589(lit.)
Boiling Point:300 °C(lit.)
Flash Point:230 °F
PSA：29.43000
Density:1.11 g/mL at 25 °C(lit.)
LogP:3.24470
Storage Temp.:2-8°C
XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:209.084063974
Heavy Atom Count:16
Complexity:244

Purity/Quality:

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

4-BENZYLPHENYL ISOCYANATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 20/21/22-36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CC2=CC=C(C=C2)N=C=O
Recent ClinicalTrials:Prevention Relapse of Graves' Disease by Intrathyroid Injection of Dexamethasone

Technology Process of alpha-Phenyl-p-tolyl isocyanate

There total 2 articles about alpha-Phenyl-p-tolyl isocyanate 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:

: 75-44-5
phosgene

: 1135-12-2
p-benzylaniline

: 1823-37-6
1-benzyl-4-isocyanatobenzene

Guidance literature:

Reference yield:

: 1823-37-6
1-benzyl-4-isocyanatobenzene

Guidance literature:: Benzylchlorid, Phenylisocyanat, FeCl3;

Reference yield: 87.0%

: 617245-60-0
N-(1-benzyl-piperidin-4-yl)-2-methoxy-4-methylamino-benzamide

: 1823-37-6
1-benzyl-4-isocyanatobenzene

: 617245-61-1
4-[3-(4-benzyl-phenyl)-1-methyl-ureido]-N-(1-benzyl-piperidin-4-yl)-2-methoxy-benzamide

Guidance literature:: N-(1-benzyl-piperidin-4-yl)-2-methoxy-4-methylamino-benzamide; 1-benzyl-4-isocyanatobenzene; In dichloromethane; for 96h;

With PS-Trisamine; In dichloromethane; for 48h;