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Substance Name: Phenanthridine
RN: 229-87-8
UNII: 62QGS7CPS6
InChIKey: RDOWQLZANAYVLL-UHFFFAOYSA-N
Classification Code
- Mutation Data
Molecular Formula
- C13-H9-N
Molecular Weight
- 179.221
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Names and Synonyms
Name of Substance
- Phenanthridine
Synonyms
- 3,4-Benzoisoquinoline
- 3,4-Benzoquinoline
- 5-20-08-00223 (Beilstein Handbook Reference)
- 5-Azaphenanthrene
- 6-Phenanthridine
- 9-Azaphenanthrene
- Benzo(c)quinoline
- BRN 0120204
- CCRIS 1234
- EINECS 205-934-4
- NSC 73482
- Phenanthridine
- UNII-62QGS7CPS6
Systematic Name
- Phenanthridine
Registry Numbers
CAS Registry Number
- 229-87-8
FDA UNII
- 62QGS7CPS6
System Generated Number
- 0000229878
Structure Descriptors
InChI
InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9HInChIKey
RDOWQLZANAYVLL-UHFFFAOYSA-NSmiles
c1ccc2c(c1)Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 107.4 | deg C | EXP | |
| Boiling Point | 349 | deg C | EXP | |
| pKa Dissociation Constant | 4.61 | (none) | 20 | EXP |
| log P (octanol-water) | 3.48 | (none) | EXP | |
| Water Solubility | 300 | mg/L | 20 | EXP |
| Vapor Pressure | 2.08E-05 | mm Hg | 25 | EXP |
| Henry's Law Constant | 1.64E-08 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 9.00E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.