| CAS Number | 891642-99-2 |
| Catalog Number | AG003WGR(AGN-PC-0WB40J) |
| Chemical Name | 2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)propan-1-amine |
| IUPAC Name | 2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropan-1-amine |
| InChI | InChI=1S/C13H20N2/c1-13(2,10-14)15-8-7-11-5-3-4-6-12(11)9-15/h3-6H,7-10,14H2,1-2H3 |
| InChI Key | RUZNMAAWLDJWOC-UHFFFAOYSA-N |
| MDL Number | MFCD05201595 |
| Molecular Formula | C13H20N2 |
| Molecular Weight | 204.3113 |
| SMILES | CC(N1CC2=C(C=CC=C2)CC1)(CN)C |
| Synonyms | 891642-99-2,
2-(3,4-DIHYDRO-2(1H)-ISOQUINOLINYL)-2-METHYL-1-PROPANAMINE,
2-(3,4-Dihydroisoquinolin-2(1H)-yl)-2-methylpropan-1-amine,
2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)propan-1-amine,
SCHEMBL4666005,
CTK5G2577,
DTXSID30588149,
MFCD05201595,
ZINC23094243,
AKOS000126942,
MCULE-8008144483,
NE13017,
AJ-81675,
2-(3,4-DIHYDROISOQUINOLIN-2 -2-METHYLPROPAN-1-AMINE,
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| Complexity | 213 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.317g/mol |
| Monoisotopic Mass | 204.163g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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