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Substance Name: 2-Benzoylpyridine
RN: 91-02-1
UNII: IZ1TTI0X5O
InChIKey: GCSHUYKULREZSJ-UHFFFAOYSA-N
Molecular Formula
- C12-H9-N-O
Molecular Weight
- 183.209
- All
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- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 2-Benzoylpyridine
Synonyms
- 2-Benzoylpyridine
- 2-Pyridyl phenyl ketone
- 5-21-08-00566 (Beilstein Handbook Reference)
- AI3-52531
- BRN 0120283
- EINECS 202-034-3
- NSC 20887
- Phenyl 2-pyridyl ketone
- Pyridine, 2-benzoyl-
- UNII-IZ1TTI0X5O
Systematic Names
- Ketone, phenyl 2-pyridyl
- Methanone, phenyl-2-pyridinyl-
- Phenyl 2-pyridyl ketone
Registry Numbers
CAS Registry Number
- 91-02-1
FDA UNII
- IZ1TTI0X5O
System Generated Number
- 0000091021
Structure Descriptors
InChI
InChI=1S/C12H9NO/c14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-9HInChIKey
GCSHUYKULREZSJ-UHFFFAOYSA-NSmiles
O=C(c1ccccc1)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 475mg/kg (475mg/kg) | Journal of Medicinal Chemistry. Vol. 14, Pg. 551, 1971. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 42 | deg C | EXP | |
| Boiling Point | 317 | deg C | EXP | |
| log P (octanol-water) | 1.88 | (none) | EXP | |
| Water Solubility | 1320 | mg/L | 25 | EST |
| Vapor Pressure | 3.67E-04 | mm Hg | 25 | EST |
| Henry's Law Constant | 2.54E-09 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 2.11E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.