| CAS Number | 1540796-76-6 |
| Catalog Number | AG01B700 |
| Chemical Name | (2,3-dihydro-1-benzofuran-4-yl)methanamine |
| IUPAC Name | 2,3-dihydro-1-benzofuran-4-ylmethanamine |
| InChI | InChI=1S/C9H11NO/c10-6-7-2-1-3-9-8(7)4-5-11-9/h1-3H,4-6,10H2 |
| InChI Key | XVFCNTQRGHDWLM-UHFFFAOYSA-N |
| MDL Number | MFCD22398270 |
| Molecular Formula | C9H11NO |
| Molecular Weight | 149.1897 |
| SMILES | O1CCC2=C1C=CC=C2CN |
| Synonyms | 1540796-76-6,
(2,3-Dihydrobenzofuran-4-yl)methanamine,
SCHEMBL17841440,
ZINC82840215,
2,3-dihydro-1-benzofuran-4-ylmethanamine,
(2,3-dihydro-1-benzofuran-4-yl)methanamine,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.193g/mol |
| Monoisotopic Mass | 149.084g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number