| CAS Number | 105329-58-6 |
| Catalog Number | AG01C07I(AGN-PC-0384GF) |
| Chemical Name | 8-methoxy-3,4-dihydro-2H-1-benzopyran-4-ol |
| IUPAC Name | 8-methoxy-3,4-dihydro-2H-chromen-4-ol |
| InChI | InChI=1S/C10H12O3/c1-12-9-4-2-3-7-8(11)5-6-13-10(7)9/h2-4,8,11H,5-6H2,1H3 |
| InChI Key | IPPYUHFZRVBTPO-UHFFFAOYSA-N |
| MDL Number | MFCD11899789 |
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.2005 |
| SMILES | COC1=C2C(C(CCO2)O)=CC=C1 |
| Synonyms | 8-methoxy-3,4-dihydro-2H-1-benzopyran-4-ol,
105329-58-6,
SCHEMBL10638224,
IPPYUHFZRVBTPO-UHFFFAOYSA-N,
AKOS014320144,
4-Hydroxy-8-methoxy-2,3-dihydrobenzopyran,
Z2719320778,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.203g/mol |
| Monoisotopic Mass | 180.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number