| CAS Number | 6440-87-5 |
| Catalog Number | AG019SDC |
| Chemical Name | 2-(2-methoxyphenoxy)propan-1-amine |
| IUPAC Name | 2-(2-methoxyphenoxy)propan-1-amine |
| InChI | InChI=1S/C10H15NO2/c1-8(7-11)13-10-6-4-3-5-9(10)12-2/h3-6,8H,7,11H2,1-2H3 |
| InChI Key | BIWHLVXMIXGLJA-UHFFFAOYSA-N |
| MDL Number | MFCD07374159 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | COC1=C(OC(CN)C)C=CC=C1 |
| Synonyms | 1-[(1-AMINOPROPAN-2-YL)OXY]-2-METHOXYBENZENE,
6440-87-5,
2-(2-METHOXYPHENOXY)PROPAN-1-AMINE,
SCHEMBL7412875,
2-(2-Methoxy-phenoxy)propylamine,
BIWHLVXMIXGLJA-UHFFFAOYSA-N,
AKOS008148079,
AB38901,
MCULE-3267091723,
NE19017,
EN300-93210,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.235g/mol |
| Monoisotopic Mass | 181.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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