| CAS Number | 1423032-93-2 |
| Catalog Number | AG01A38U |
| Chemical Name | 2-(1-Aminoethyl)aniline dihydrochloride |
| IUPAC Name | 2-(1-aminoethyl)aniline;dihydrochloride |
| InChI | InChI=1S/C8H12N2.2ClH/c1-6(9)7-4-2-3-5-8(7)10;;/h2-6H,9-10H2,1H3;2*1H |
| InChI Key | CYZXOUYXVLWRTQ-UHFFFAOYSA-N |
| MDL Number | MFCD22628544 |
| Molecular Formula | C8H14Cl2N2 |
| Molecular Weight | 209.1162 |
| SMILES | NC1=CC=CC=C1C(N)C.[H]Cl.[H]Cl |
| Synonyms | 2-(1-aminoethyl)aniline dihydrochloride,
1423032-93-2,
NE31627,
2-(1-aminoethyl)aniline hydrochloride,
|
| Complexity | 103 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.114g/mol |
| Monoisotopic Mass | 208.053g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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