| CAS Number | 1181457-97-5 |
| Catalog Number | AG019VH7 |
| Chemical Name | N-[(4-methylphenyl)methyl]-2,3-dihydro-1H-inden-1-amine hydrochloride |
| IUPAC Name | N-[(4-methylphenyl)methyl]-2,3-dihydro-1H-inden-1-amine;hydrochloride |
| InChI | InChI=1S/C17H19N.ClH/c1-13-6-8-14(9-7-13)12-18-17-11-10-15-4-2-3-5-16(15)17;/h2-9,17-18H,10-12H2,1H3;1H |
| InChI Key | RVEIRNWKBDRYIR-UHFFFAOYSA-N |
| MDL Number | MFCD12197173 |
| Molecular Formula | C17H20ClN |
| Molecular Weight | 273.8004 |
| SMILES | Cl.CC1=CC=C(CNC2C3=C(C=CC=C3)CC2)C=C1 |
| Synonyms | N-[(4-methylphenyl)methyl]-2,3-dihydro-1H-inden-1-amine hydrochloride,
1181457-97-5,
AC1Q39GH,
CTK6B8368,
AKOS008074635,
MCULE-5726137642,
NE37305,
EN300-45235,
|
| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.804g/mol |
| Monoisotopic Mass | 273.128g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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