|
|
|
Substance Name: 4-Phenylpyrimidine
RN: 3438-48-0
UNII: VQR91IRU2R
InChIKey: MKLQPIYLZMLAER-UHFFFAOYSA-N
Molecular Formula
- C10-H8-N2
Molecular Weight
- 156.187
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
Names and Synonyms
Name of Substance
- 4-Phenylpyrimidine
Synonyms
- 4-Phenylpyrimidine
- 5-23-08-00009 (Beilstein Handbook Reference)
- 6-Phenylpyrimidine
- BRN 0112781
- EINECS 222-345-8
- NSC 84249
- UNII-VQR91IRU2R
Systematic Names
- 4-Phenylpyrimidine
- Pyrimidine, 4-phenyl-
Registry Numbers
CAS Registry Number
- 3438-48-0
FDA UNII
- VQR91IRU2R
System Generated Number
- 0003438480
Structure Descriptors
InChI
1S/C10H8N2/c1-2-4-9(5-3-1)10-6-7-11-8-12-10/h1-8HInChIKey
MKLQPIYLZMLAER-UHFFFAOYSA-NSmiles
c1(c2ccncn2)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 100mg/kg (100mg/kg) | U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12247, |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 54-58 | deg C | EXP | |
| log P (octanol-water) | 1.92 | (none) | EXP | |
| Water Solubility | 1630 | mg/L | 25 | EST |
| Vapor Pressure | 1.20E-03 | mm Hg | 25 | EST |
| Henry's Law Constant | 2.24E-07 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 3.79E-12 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.