AC1L6T9P
6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-amine;4-methylbenzenesulfonic acid
Also Known As: 4-(2,2-dimethyl-1,3-dioxolan-4-yl)-7,7-dimethyl-3,6,8-trioxabicyclo[3.3.0]octan-2-amine; 4-methylbenzenesulfonic acid|4-Methylbenzene-1-sulfonic acid--6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyltetrahydro-2H-furo[3,4-d][1,3]dioxol-4-amine (1/1)|6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-amine; 4-methylbenzenesulfonic acid|6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-amine;4-methylbenzenesulfonic acid
| Molecular Formula | C19H29NO8S |
|---|---|
| Molecular Weight | 431.16138 g/mol |
| LogP | 1.58332 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 431.16138 |
| Monoisotopic Mass | 431.16138 |
| Heavy Atoms | 29 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 52485-63-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.CC1(OCC(O1)C2C3C(C(O2)N)OC(O3)(C)C)C |
| InChIKey | GJPGXLLYKJRBMY-UHFFFAOYSA-N |
Product Overview
AC1L6T9P (CAS 52485-63-9), with molecular formula C19H29NO8S and molecular weight 431.16138 g/mol. IUPAC: 6-(2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-amine;4-methylbenzenesulfonic acid.
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