3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate (CAS 94166-79-7) — formula C16H18N2O2, molecular weight 270.33; category organic chemicals.
| CAS Number | 94166-79-7 |
|---|---|
| Molecular Formula | C16H18N2O2 |
| Molecular Weight | 270.33 |
| LogP | 5.8 |
| Category | Organic Chemicals |
3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate is a carbon-based organic compound with CAS registry number 94166-79-7 and molecular formula C16H18N2O2 (molecular weight 270.33), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94166-79-7
Its molecular formula C16H18N2O2 comprises 16 C, 18 H, 2 N, 2 O atoms.
Also known as: 3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate · 3-[(2-异氰酸环己基)甲基]-邻甲苯基异氰酸酯
Category: organic chemicals
The CAS registry number of 3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate is 94166-79-7.
Molecular formula C16H18N2O2, molecular weight 270.33.
It is also registered under: 3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate, 3-[(2-异氰酸环己基)甲基]-邻甲苯基异氰酸酯.
Category: Organic Chemicals.
Independent reference data for 3-[(2-isocyanatocyclohexyl)methyl]-o-tolyl isocyanate (CAS 94166-79-7), compiled from public chemistry databases.
| CAS 号 | 94166-79-7 |
|---|---|
| PubChem CID | 3023929 |
| 分子式 | C16H18N2O2 |
| IUPAC 名称 | 1-isocyanato-3-[(2-isocyanatocyclohexyl)methyl]-2-methylbenzene |
| UNII（FDA） | NS00066718 |
| Molecular Weight | 270.33 |
|---|---|
| XLogP3 | 5.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 270.136827821 |
| Monoisotopic Mass | 270.136827821 |
| Topological Polar Surface Area | 58.9 |
| Heavy Atom Count | 20 |
94166-79-7; EINECS 303-377-2; 3-((2-Isocyanatocyclohexyl)methyl)-o-tolyl isocyanate; 1-isocyanato-3-[(2-isocyanatocyclohexyl)methyl]-2-methylbenzene; DTXSID90916207; HVZNNFVEMZLASN-UHFFFAOYSA-N; NS00066718
3-[(2-异氰酸环己基)甲基]-邻甲苯基异氰酸酯 · CAS 94166-79-7 · C16H18N2O2. UNII NS00066718.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.