Methyl 2-(2-Pyrimidyl)acetate - CAS 60561-50-4
Catalog: |
BB030728 |
Product Name: |
Methyl 2-(2-Pyrimidyl)acetate |
CAS: |
60561-50-4 |
Synonyms: |
2-(2-pyrimidinyl)acetic acid methyl ester; methyl 2-pyrimidin-2-ylacetate |
IUPAC Name: | methyl 2-pyrimidin-2-ylacetate |
Description: | Methyl 2-(2-Pyrimidyl)acetate (CAS# 60561-50-4) is a useful research chemical. |
Molecular Weight: | 152.15 |
Molecular Formula: | C7H8N2O2 |
Canonical SMILES: | COC(=O)CC1=NC=CC=N1 |
InChI: | InChI=1S/C7H8N2O2/c1-11-7(10)5-6-8-3-2-4-9-6/h2-4H,5H2,1H3 |
InChI Key: | ZDUBLLCAMMIGFH-UHFFFAOYSA-N |
Boiling Point: | 220.1 °C at 760 mmHg |
Density: | 1.182 g/cm3 |
LogP: | 0.19210 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021158634-A1 | Irak degraders and uses thereof | 20200203 |
KR-20180043343-A | Aryl, heteroaryl, and heterocyclic compounds for the treatment of medical disorders | 20150826 |
KR-20170032468-A | Piperazine derivatives as liver x receptor modulators | 20140807 |
AU-2014294867-A1 | Novel indolizine derivatives, method for the production thereof and pharmaceutical compositions containing same | 20130723 |
AU-2014294867-B2 | Novel indolizine derivatives, method for the production thereof and pharmaceutical compositions containing same | 20130723 |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.058577502 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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