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Substance Name: Adrenochrome
RN: 54-06-8
UNII: 70G54NQL71
InChIKey: RPHLQSHHTJORHI-UHFFFAOYSA-N
Note
- Pigment obtained by the oxidation of epinephrine.
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C9-H9-N-O3
Molecular Weight
- 179.1741
- All
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- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Adrenochrome
MeSH Heading
- Adrenochrome
Synonyms
- 2,3-Dihydro-3-hydroxy-1-methyl-1H-indole-5,6-dione
- 3-Hydroxy-1-methyl-5,6-indolinedione
- Adraxone
- Adrenochrome
- EINECS 200-192-8
- UNII-70G54NQL71
- USAF uctl-7
Systematic Names
- 1H-Indole-5,6-dione, 2,3-dihydro-3-hydroxy-1-methyl-
- 3-Hydroxy-1-methylindoline-5,6-dione
- 5,6-Indolinedione, 3-hydroxy-1-methyl-
Registry Numbers
CAS Registry Number
- 54-06-8
FDA UNII
- 70G54NQL71
System Generated Number
- 0000054068
Structure Descriptors
InChI
InChI=1S/C9H9NO3/c1-10-4-9(13)5-2-7(11)8(12)3-6(5)10/h2-3,9,13H,4H2,1H3InChIKey
RPHLQSHHTJORHI-UHFFFAOYSA-NSmiles
CN1CC(O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | National Technical Information Service. Vol. AD277-689, | |
mouse | LD50 | intravenous | 128mg/kg (128mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 106, Pg. 90, 1956. | |
rat | LD50 | intraperitoneal | 150mg/kg (150mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 106, Pg. 90, 1956. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | 125 dec | deg C | EXP | |
log P (octanol-water) | -1.730 | (none) | EST | |
Atmospheric OH Rate Constant | 1.11E-10 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.