| CAS Number | 67536-29-2 |
| Catalog Number | AG003DJR(AGN-PC-006Z3C) |
| Chemical Name | 1,3-Dihydro-1-methoxyisobenzofuran |
| IUPAC Name | 1-methoxy-1,3-dihydro-2-benzofuran |
| InChI | InChI=1S/C9H10O2/c1-10-9-8-5-3-2-4-7(8)6-11-9/h2-5,9H,6H2,1H3 |
| InChI Key | HHFOTZJVYJNYJC-UHFFFAOYSA-N |
| MDL Number | MFCD12407127 |
| Molecular Formula | C9H10O2 |
| Molecular Weight | 150.1745 |
| SMILES | COC1OCC2=CC=CC=C12 |
| Synonyms | 1,3-Dihydro-1-methoxyisobenzofuran,
67536-29-2,
1-methoxy-1,3-dihydroisobenzofuran,
1-Methoxyisocoumaran,
ACMC-209nzx,
SCHEMBL3418110,
CTK8B2140,
DTXSID30462556,
ANW-35371,
MFCD12407127,
TC-124116,
1-METHOXY-1,3-DIHYDRO-2-BENZOFURAN,
D3828,
CID11332556,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.177g/mol |
| Monoisotopic Mass | 150.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number