Pyrimidine-2-carboxylic acid - CAS 31519-62-7
Catalog: |
BB020957 |
Product Name: |
Pyrimidine-2-carboxylic acid |
CAS: |
31519-62-7 |
Synonyms: |
pyrimidine-2-carboxylic acid |
IUPAC Name: | pyrimidine-2-carboxylic acid |
Description: | Pyrimidine-2-carboxylic acid (CAS# 31519-62-7) is a useful research chemical. |
Molecular Weight: | 124.10 |
Molecular Formula: | C5H4N2O2 |
Canonical SMILES: | C1=CN=C(N=C1)C(=O)O |
InChI: | InChI=1S/C5H4N2O2/c8-5(9)4-6-2-1-3-7-4/h1-3H,(H,8,9) |
InChI Key: | ZFCHNZDUMIOWFV-UHFFFAOYSA-N |
Boiling Point: | 362.6 °C at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.403 g/cm3 |
Appearance: | White to yellow powder |
MDL: | MFCD00856161 |
LogP: | 0.17480 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113466356-A | Sample pretreatment and detection method for determining pesticide residue content in cow milk | 20210603 |
CN-112979672-A | 11, 20-dicarbonyl oridonin 14-O esterified series derivatives and application thereof | 20210305 |
CN-112898314-A | Preparation and application of deubiquitinase inhibitor | 20201106 |
CN-111956619-A | Freeze-dried powder preparation for preventing myopia and improving eyesight and preparation method thereof | 20200909 |
CN-111568869-A | Freeze-dried powder preparation for preventing and improving and nursing xerophthalmia and preparation method thereof | 20200706 |
PMID | Publication Date | Title | Journal |
21388127 | 20110727 | Fast extraction and dilution flow injection mass spectrometry method for quantitative chemical residue screening in food | Journal of agricultural and food chemistry |
21836828 | 20110701 | Poly[di-μ(2)-aqua-μ(2)-(5-methyl-pyrazine-2-carboxyl-ato)-(5-methyl-pyrazine-2-carboxyl-ato)-μ(3)-nitrato-trilithium] | Acta crystallographica. Section E, Structure reports online |
21569315 | 20110511 | Genome-wide dynamics of a bacterial response to antibiotics that target the cell envelope | BMC genomics |
21588484 | 20100804 | catena-Poly[[(pyrimidine-2-carb-oxy-lic acid)iron(II)]-μ-oxalato] | Acta crystallographica. Section E, Structure reports online |
21588197 | 20100721 | Poly[tetra-μ(1,1)-azido-bis-(μ(2)-pyrimidine-2-carboxyl-ato)tricopper(II)] | Acta crystallographica. Section E, Structure reports online |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.027277375 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.027277375 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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