2-chloropyrimidine-5-carboxylic Acid

Base Information

• Chemical Name: 2-chloropyrimidine-5-carboxylic Acid
• CAS No.: 374068-01-6
• Molecular Formula: C₅H₃ClN₂O₂
• Molecular Weight: 158.544
• Hs Code.: 29335990
• European Community (EC) Number: 691-354-0
• DSSTox Substance ID: DTXSID30454936
• Wikidata: Q72458901
• Mol file: 374068-01-6.mol

Synonyms:2-chloropyrimidine-5-carboxylic Acid;374068-01-6;2-Chloro-pyrimidine-5-carboxylic acid;2-Chloro-5-carboxypyrimidine;2-Chloropyrimidine-5-carboxylicacid;MFCD06739036;5-Pyrimidinecarboxylicacid, 2-chloro-;SCHEMBL63857;DTXSID30454936;DUCXUPKLVVSJKA-UHFFFAOYSA-N;BCP27466;2-Chloropyrimidine 5-carboxylic acid;BBL102704;STL556510;2-chloro-5-pyrimidine carboxylic acid;AKOS005259158;CS-W019608;PB24941;PS-5015;AC-28232;SY019434;2-CHLORO-5-PYRIMIDINECARBOXYLIC ACID;A6396;AM20090600;FT-0601815;EN300-93959;2-chloropyrimidine-5-carboxylic acid, AldrichCPR;Q-103422;Z1143448915;2-Chloropyrimidine-5-carboxylic Acid

Chemical Property of 2-chloropyrimidine-5-carboxylic Acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 126-131 °C
• Refractive Index: 1.598
• Boiling Point: 411.407 °C at 760 mmHg
• PKA: 2.51±0.10(Predicted)
• Flash Point: 202.612 °C
• PSA: 63.08000
• Density: 1.58 g/cm³
• LogP: 0.82820
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 157.9883050
• Heavy Atom Count: 10
• Complexity: 134

Purity/Quality:

98% ^*data from raw suppliers

2-Chloro-pyrimidine-5-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=NC(=N1)Cl)C(=O)O
• Uses: 2-Chloropyrimidine-5-carboxylic acid is carboxylic acid organic compounds, mainly used as pharmaceutical intermediates. 2-Chloropyrimidine-5-carboxylic Acid is a compound involved in the synthesis of novel (6-aminopyridin-3-yl)(4-(pyridin-2-yl)piperazin-1-yl) methanone derivatives as TRPV4 antagonists for the treatment of pain.