58244-27-2 Purity
97%
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Specification
The molecular formula of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is C11H11NO.
The molecular weight of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is 173.21 g/mol.
The IUPAC name of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is 1-isocyanato-1,2,3,4-tetrahydronaphthalene.
The InChI of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is InChI=1S/C11H11NO/c13-8-12-11-7-3-5-9-4-1-2-6-10(9)11/h1-2,4,6,11H,3,5,7H2.
The InChIKey of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is OABBXWCERFBLEZ-UHFFFAOYSA-N.
The canonical SMILES of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is C1CC(C2=CC=CC=C2C1)N=C=O.
The CAS number of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is 58490-95-2.
The European Community (EC) number of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is 624-957-4.
The XLogP3-AA value of 1-Isocyanato-1,2,3,4-Tetrahydronaphthalene is 3.4.
1-Isocyanato-1,2,3,4-Tetrahydronaphthalene has 2 hydrogen bond acceptors.