2-(4-(3-(Dibutylamino)propoxy)-3,5-dimethylbenzoyl)-2-benzopyrone hydrochloride
[4-[3-(dibutylamino)propoxy]-3,5-dimethylphenyl]-(2-hydroxychromen-2-yl)methanone;hydrochloride
Also Known As: EINECS 266-839-1|2-(4-(3-(Dibutylamino)propoxy)-3,5-dimethylbenzoyl)-2-benzopyrone hydrochloride|2-[4-[3-(Dibutylamino)propoxy]-3,5-dimethylbenzoyl]-2-benzopyrone hydrochloride|{4-[3-(Dibutylamino)propoxy]-3,5-dimethylphenyl}(2-hydroxy-2H-chromen-2-yl)methanone hydrochloride|[4-[3-(dibutylamino)propoxy]-3,5-dimethylphenyl]-(2-hydroxychromen-2-yl)methanone hydrochloride|{4-[3-(Dibutylamino)propoxy]-3,5-dimethylphenyl}(2-hydroxy-2H-1-benzopyran-2-yl)methanone--hydrogen chloride (1/1)
| Molecular Formula | C29H40ClNO4 |
|---|---|
| Molecular Weight | 501.2646 g/mol |
| LogP | 6.37344 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 501.2646 |
| Monoisotopic Mass | 501.2646 |
| Heavy Atoms | 35 |
| Complexity | 974.92145 |
Chemical Identifiers
| CAS Number | 67652-33-9 |
|---|---|
| SMILES | CCCCN(CCCC)CCCOC1=C(C=C(C=C1C)C(=O)C2(C=CC3=CC=CC=C3O2)O)C.Cl |
Product Overview
2-(4-(3-(Dibutylamino)propoxy)-3,5-dimethylbenzoyl)-2-benzopyrone hydrochloride (CAS 67652-33-9), with molecular formula C29H40ClNO4 and molecular weight 501.2646 g/mol. IUPAC: [4-[3-(dibutylamino)propoxy]-3,5-dimethylphenyl]-(2-hydroxychromen-2-yl)methanone;hydrochloride.