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13036-57-2

Basic Information
CAS No.: 13036-57-2
Name: 2-Chloro-4-methylpyrimidine
Article Data: 34
Molecular Structure:
Molecular Structure of 13036-57-2 (2-Chloro-4-methylpyrimidine)
Formula: C5H5ClN2
Molecular Weight: 128.561
Synonyms: pyrimidine, 2-chloro-4-(tributylstannyl)-;Pyrimidine, 2-chloro-4-methyl-;
Density: 1.235 g/cm3
Melting Point: 35-36 °C
Boiling Point: 216.105 °C at 760 mmHg
Flash Point: 104.942 °C
Appearance: pale yellow solid
Hazard Symbols: IrritantXi
Risk Codes:  Xi:;
">  Xi:;
Safety: 26-39
PSA: 25.78000
LogP: 1.43840
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Chemistry

Empirical Formula: C5H5ClN2
Molecular Weight: 128.5596
Nominal Mass: 128 Da
Average Mass: 128.5596 Da
Monoisotopic Mass: 128.014126 Da 
Index of Refraction: 1.53 Molar
Refractivity: 32.155 cm3
Molar Volume: 104.107 cm3
Surface Tension: 44.63 dyne/cm
Density: 1.235 g/cm3
Flash Point: 104.942 °C
Enthalpy of Vaporization: 43.402 kJ/mol
Boiling Point: 216.105 °C at 760 mmHg
Vapour Pressure: 0.209 mmHg at 25 °C
Melting point: 35-36 °C
Appearance: Pale yellow solid
Structure of 2-Chloro-4-methylpyrimidine (CAS NO.13036-57-2):
                       
IUPAC Name: 2-Chloro-4-methylpyrimidine
Canonical SMILES: CC1=NC(=NC=C1)Cl
InChI: InChI=1S/C5H5ClN2/c1-4-2-3-7-5(6)8-4/h2-3H,1H3
InChIKey: BHAKRVSCGILCEW-UHFFFAOYSA-N
Product Category of 2-Chloro-4-methylpyrimidine (CAS NO.13036-57-2): Nucleotides and Nucleosides;Bases & Related Reagents;Nucleotides;Halides;Pyrazines, Pyrimidines & Pyridazines;Boronic Acid;Chlorinated heterocyclic series

Uses

 2-Chloro-4-methylpyrimidine (CAS NO.13036-57-2) is used as pharmaceutical intermediate.

Toxicity Data With Reference

 2-Chloro-4-methylpyrimidine (CAS NO.13036-57-2) is irritating to eyes, respiratory system and skin. 2-chloro-4-methylpyrimidine(13036-57-2) may be harmful by inhalation, ingestion, or skin absorption. it emits toxic fumes in combustion .

Safety Profile

S22: Do not breathe dust.
S36/37/39: Wear suitable protective clothing, gloves and eye / face protection.
S45: In case of accident or if you feel unwell, seek medical advice immediately.

Specification

 2-Chloro-4-methylpyrimidine , its cas register number is 13036-57-2. It also can be called Pyrimidine, 2-chloro-4-methyl- .