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Substance Name: 2-(3-(Dipropylamino)propoxy)benzhydrol methyl toluenesulfonate
RN: 13002-45-4
InChIKey: DEXNQMMOWZRSDQ-UHFFFAOYSA-M
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C23-H34-N-O2.C7-H7-O3-S
Molecular Weight
- 527.722
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Names and Synonyms
Results Name
- 2-(3-(Dipropylamino)propoxy)benzhydrol methyl toluenesulfonate
Synonyms
- 2-(3-(Dipropylamino)propoxy)benzhydrol methyl toluenesulfonate
- Benzhydrol, 2-(3-(dipropylamino)propoxy)-, methyl toluenesulfonate
- Dipropyl(3-(2-(alpha-hydroxybenzyl)phenoxy)propyl)methylammonium toluenesulfonate
Systematic Name
- Ammonium, dipropyl(3-(2-(alpha-hydroxybenzyl)phenoxy)propyl)methyl-, toluenesulfonate
Registry Numbers
CAS Registry Number
- 13002-45-4
System Generated Number
- 0013002454
Molecular Formulas
Molecular Formula
- C23-H34-N-O2.C7-H7-O3-S
Molecular Formula Fragments
- C23-H34-N-O2
- C7-H7-O3-S
- COMPONENT
Structure Descriptors
InChI
1S/C23H34NO2.C7H8O3S/c1-4-16-24(3,17-5-2)18-11-19-26-22-15-10-9-14-21(22)23(25)20-12-7-6-8-13-20;1-6-2-4-7(5-3-6)11(8,9)10/h6-10,12-15,23,25H,4-5,11,16-19H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1InChIKey
DEXNQMMOWZRSDQ-UHFFFAOYSA-MSmiles
[N+](CCCOc1c(cccc1)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | Journal of Medicinal Chemistry. Vol. 9, Pg. 804, 1966. |