2,3,3A,4,5,6-hexahydro-1h-benz[de]isoquinoline CAS 71960-94-6
| CAS No. | 71960-94-6 |
| Molecular Formula | C12H15N |
| Molecular Weight | 173.25 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO supplies 2,3,3A,4,5,6-hexahydro-1h-benz[de]isoquinoline (CAS 71960-94-6), a certified reference material (molecular formula C12H15N, MW 173.25 g/mol) for analytical method development and quality control.
Structurally, 2,3,3A,4,5,6-hexahydro-1h-benz[de]isoquinoline (C12H15N) contains a nitrogen-containing heterocyclic scaffold, a nitrile group. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 173.25 g/mol, it falls into the medium-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C12H15N |
| Molecular Weight | 173.25 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate |
| Stability | Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1977 |
| Nitrogen Atoms | 1 |
Related A Standards
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Recommended Standards
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- 2-Chloropropane-1,1,1-d3 (CAS 137832-55-4)
- 2-(Tert-butoxycarbonyl)-2,3,4,5-tetrahydro-1H-benzo[c]azepine-7-carboxylic acid (CAS 1158744-01-4)
- Aminomethylbenzoic Acid Impurity 2 (CAS 98270-32-7)
- N-Methyl-N-octyldecan-1-amine (CAS 22020-14-0)
- 4'-(Aminomethyl)-3',6'-dihydroxy-3H-spiro[isobenzofuran-1,9'-xanthen]-3-one (CAS 106754-95-4)
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- 2-Amino-6-(2-methoxyphenyl)-5,6-dihydropyrimidin-4(3H)-one (CAS 892761-69-2)
- CGMP Dependent Kinase Inhibitor Peptide (CAS 82801-73-8)
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