| CAS Number | 19484-75-4 |
| Catalog Number | AG01BETJ(AGN-PC-04ZEZ4) |
| Chemical Name | 7-hydroxy-4-methyl-3,4-dihydro-2H-1-benzopyran-2-one |
| IUPAC Name | 7-hydroxy-4-methyl-3,4-dihydrochromen-2-one |
| InChI | InChI=1S/C10H10O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-3,5-6,11H,4H2,1H3 |
| InChI Key | IOMZSWZFZSBGSN-UHFFFAOYSA-N |
| MDL Number | MFCD00100823 |
| Molecular Formula | C10H10O3 |
| Molecular Weight | 178.1846 |
| SMILES | CC1C2=C(C=C(C=C2)O)OC(=O)C1 |
| Synonyms | 19484-75-4,
7-hydroxy-4-methyl-3,4-dihydro-2H-1-benzopyran-2-one,
2H-1-Benzopyran-2-one, 3,4-dihydro-7-hydroxy-4-methyl-,
SCHEMBL3238926,
CTK0A0711,
DTXSID60648740,
IOMZSWZFZSBGSN-UHFFFAOYSA-N,
AKOS016031677,
NE11231,
7-hydroxy-3,4-dihydro-4-methylcoumarin,
Z1889710262,
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| Complexity | 214 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.187g/mol |
| Monoisotopic Mass | 178.063g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number