| CAS Number | 1247834-10-1 |
| Catalog Number | AG019T90 |
| Chemical Name | 4-[2-(3-methylpyrrolidin-1-yl)ethoxy]aniline |
| IUPAC Name | 4-[2-(3-methylpyrrolidin-1-yl)ethoxy]aniline |
| InChI | InChI=1S/C13H20N2O/c1-11-6-7-15(10-11)8-9-16-13-4-2-12(14)3-5-13/h2-5,11H,6-10,14H2,1H3 |
| InChI Key | YLHBEZCQRXWMKK-UHFFFAOYSA-N |
| MDL Number | MFCD14600855 |
| Molecular Formula | C13H20N2O |
| Molecular Weight | 220.3107 |
| SMILES | CC1CN(CCOC2=CC=C(N)C=C2)CC1 |
| Synonyms | 4-[2-(3-methylpyrrolidin-1-yl)ethoxy]aniline,
1247834-10-1,
AKOS010473147,
MCULE-3922934137,
NE35056,
Z1318186468,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.316g/mol |
| Monoisotopic Mass | 220.158g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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