CID6455868
1,3-diisocyanato-2-methylbenzene;2-(4-methylcyclohex-3-en-1-yl)propan-2-ol;tricyclo[5.2.1.02,6]dec-3-en-8-ol
Also Known As: (C10-H18-O.C10-H14-O.C9-H6-N2-O2)x-|4,7-Methano-1H-inden-6-ol, 3a,4,5,6,7,7a-hexahydro-, polymer with 1,3-diisocyanatomethylbenzene and .alpha.,.alpha.,4-trimethyl-3-cyclohexene-1-methanol|3a,4,5,6,7,7a-Hexahydro-4,7-methano-1H-inden-6-ol, toluene diisocyanate, alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol polymer|4,7-Methano-1H-inden-6-ol, 3a,4,5,6,7,7a-hexahydro-, polymer with 1,3-diisocyanatomethylbenzene and alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol
| Molecular Formula | C29H38N2O4 |
|---|---|
| Molecular Weight | 478.28317 g/mol |
| LogP | 6.01272 |
| Topological Polar Surface Area | 99.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 478.28317 |
| Monoisotopic Mass | 478.28317 |
| Heavy Atoms | 35 |
| Complexity | 1005.0018 |
Chemical Identifiers
| CAS Number | 68334-89-4 |
|---|---|
| SMILES | CC1=CCC(CC1)C(C)(C)O.CC1=C(C=CC=C1N=C=O)N=C=O.C1C=CC2C1C3CC2CC3O |
Product Overview
CID6455868 (CAS 68334-89-4), with molecular formula C29H38N2O4 and molecular weight 478.28317 g/mol. IUPAC: 1,3-diisocyanato-2-methylbenzene;2-(4-methylcyclohex-3-en-1-yl)propan-2-ol;tricyclo[5.2.1.02,6]dec-3-en-8-ol.
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