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63155-11-3 | Ethyl 2-(pyrimidin-2-yl);acetate
CAS No: 63155-11-3 Catalog No: AG003Q1J MDL No:MFCD09953517
Product Description
Catalog Number:
AG003Q1J
Chemical Name:
Ethyl 2-(pyrimidin-2-yl);acetate
CAS Number:
63155-11-3
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD09953517
IUPAC Name:
ethyl 2-pyrimidin-2-ylacetate
InChI:
InChI=1S/C8H10N2O2/c1-2-12-8(11)6-7-9-4-3-5-10-7/h3-5H,2,6H2,1H3
InChI Key:
DZQZAEMLHNEMEN-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1ncccn1
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Synthesis and spectral characterization of new bis(2-(pyrimidin-2-yl)ethoxy)alkanes and their pharmacological activity. | Archiv der Pharmazie 20120801 |
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