| CAS Number | 749849-18-1 |
| Catalog Number | AG00GA2D(AGN-PC-03Q31F) |
| Chemical Name | N-Ethyl-4-methoxybenzeneethanamine |
| IUPAC Name | N-ethyl-2-(4-methoxyphenyl)ethanamine |
| InChI | InChI=1S/C11H17NO/c1-3-12-9-8-10-4-6-11(13-2)7-5-10/h4-7,12H,3,8-9H2,1-2H3 |
| InChI Key | XSGSTHQZHRLSHO-UHFFFAOYSA-N |
| MDL Number | MFCD09907238 |
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.2588 |
| SMILES | CCNCCc1ccc(cc1)OC |
| Synonyms | ethyl[2-(4-methoxyphenyl)ethyl]amine,
749849-18-1,
N-Ethyl-4-methoxy-benzeneethanamine,
SCHEMBL5652930,
MFCD09907238,
AKOS000234653,
2-Amino-indan-2-carboxylicacidmethylesterHCl,
F1911-1802,
199330-64-8,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.263g/mol |
| Monoisotopic Mass | 179.131g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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