BENZOIC ACID, m-(PROPYLTHIO)-, 3-(DIETHYLAMINO)PROPYL ESTER
3-(diethylamino)propyl 3-propylsulfanylbenzoate
| Molecular Formula | C17H27NO2S |
|---|---|
| Molecular Weight | 309.5 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 54.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 309.17624 |
| Heavy Atoms | 21 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 67031-78-1 |
|---|---|
| SMILES | CCCSC1=CC=CC(=C1)C(=O)OCCCN(CC)CC |
| InChIKey | KWNMJCJSHOJOOT-UHFFFAOYSA-N |
📖 Product Overview
BENZOIC ACID, m-(PROPYLTHIO)-, 3-(DIETHYLAMINO)PROPYL ESTER (CAS: 67031-78-1) is a chemical compound with molecular formula C17H27NO2S and molecular weight 309.5 g/mol. Its IUPAC systematic name is 3-(diethylamino)propyl 3-propylsulfanylbenzoate.
KWNMJCJSHOJOOT-UHFFFAOYSA-N.
SMILES: CCCSC1=CC=CC(=C1)C(=O)OCCCN(CC)CC.
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