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| CAS No.: | 24622-60-4 |
|---|---|
| Name: | 3',4'-(Methylenedioxy)-2-(1-pyrrolidinyl)butyrophenone Hydrochloride |
| Molecular Structure: | |
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| Formula: | C15H19NO3·ClH |
| Molecular Weight: | 297.78 |
| Synonyms: | Butyrophenone, 3',4'-(methylenedioxy)-2-(1-pyrrolidinyl)-, hydrochloride (8CI);1-Butanone, 1-(1,3-benzodioxol-5-yl)-2-(1-pyrrolidinyl)-, hydrochloride (9CI);1-(3',4'-Methylenedioxyphenyl)-2-pyrrolidino-1-butanone hydrochloride;3',4'-Methylenedioxy-α-pyrrolidinobutiophenone hydrochloride; |
| EINECS: | 200-659-6 |
| Flash Point: | 9℃ |
| Hazard Symbols: | F,T |
| Risk Codes: | 11-23/24/25-39/23/24/25 |
| Safety: | 7-16-36/37-45 |
| PSA: | 38.77000 |
| LogP: | 3.21230 |
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Specification
The 1-(1,3-Benzodioxol-5-yl)-2-(1-pyrrolidinyl)-1-butanone hydrochloride (1:1), with the CAS registry number 24622-60-4, is also known as 1-(3',4'-Methylenedioxyphenyl)-2-pyrrolidino-1-butanone hydrochloride. It belongs to the product categories of Amines; Heterocycles; Intermediates & Fine Chemicals; Pharmaceuticals. This chemical's molecular formula is C15H19NO3·ClH and molecular weight is 297.78. What's more, its systematic name is 1-(1,3-Benzodioxol-5-yl)-2-pyrrolidin-1-yl-butan-1-one hydrochloride.
You can still convert the following datas into molecular structure:
(1)SMILES: CCC(C(=O)c1ccc2c(c1)OCO2)N3CCCC3.Cl
(2)Std. InChI: InChI=1S/C15H19NO3.ClH/c1-2-12(16-7-3-4-8-16)15(17)11-5-6-13-14(9-11)19-10-18-13;/h5-6,9,12H,2-4,7-8,10H2,1H3;1H
(3)Std. InChIKey: ATCKCJHEOJFKJW-UHFFFAOYSA-N