Benzene, 1,1',1''-methylidynetris(4-isocyanato-
TL;DR: Benzene, 1,1',1''-methylidynetris(4-isocyanato- (CAS 2422-91-5) is a chemical compound with molecular formula C22H13N3O3 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(4-isocyanatophenyl)methyl]-4-isocyanatobenzene
Also Known As: Pyrazine 1-oxide, tris(4-isocyanatophenyl)methane, triphenylmethanetriisocyanate, Methylidynetri-p-phenylene triisocyanate, Benzene, 1,1',1''-methylidynetris[4-isocyanato-
| Molecular Formula | C22H13N3O3 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.0957 |
| Heavy Atoms | 28 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 2422-91-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C2=CC=C(C=C2)N=C=O)C3=CC=C(C=C3)N=C=O)N=C=O |
| InChIKey | LTIKIBFTASQKMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,1',1''-methylidynetris(4-isocyanato- (CAS 2422-91-5), with molecular formula C22H13N3O3 and molecular weight 367.10 g/mol. IUPAC: 1-[bis(4-isocyanatophenyl)methyl]-4-isocyanatobenzene.
Chemical Property Profile of Benzene, 1,1',1''-methylidynetris(4-isocyanato-
Property Insights of Benzene, 1,1',1''-methylidynetris(4-isocyanato-
The XLogP value of 7.7 indicates that Benzene, 1,1',1''-methylidynetris(4-isocyanato- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1,1',1''-methylidynetris(4-isocyanato-. Following Lipinski's Rule of Five, Benzene, 1,1',1''-methylidynetris(4-isocyanato- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1,1',1''-methylidynetris(4-isocyanato-?
The CAS number of Benzene, 1,1',1''-methylidynetris(4-isocyanato- is 2422-91-5.
What is the molecular formula of Benzene, 1,1',1''-methylidynetris(4-isocyanato-?
The molecular formula of Benzene, 1,1',1''-methylidynetris(4-isocyanato- is C22H13N3O3.
What is the molecular weight of Benzene, 1,1',1''-methylidynetris(4-isocyanato-?
The molecular weight of Benzene, 1,1',1''-methylidynetris(4-isocyanato- is 367.10 g/mol.
Where can I buy Benzene, 1,1',1''-methylidynetris(4-isocyanato-?
You can request a quote for Benzene, 1,1',1''-methylidynetris(4-isocyanato- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,1',1''-methylidynetris(4-isocyanato-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,1',1''-methylidynetris(4-isocyanato- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.