Home Other Building Blocks methyl 2-hydroxy-2-(pyrimidin-5-yl)acetate

methyl 2-hydroxy-2-(pyrimidin-5-yl)acetate

CAS No.:
1494496-35-3
Catalog Number:
AG01DVE7
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG01DVE7
Chemical Name:
methyl 2-hydroxy-2-(pyrimidin-5-yl)acetate
CAS Number:
1494496-35-3
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD21331152
IUPAC Name:
methyl 2-hydroxy-2-pyrimidin-5-ylacetate
InChI:
InChI=1S/C7H8N2O3/c1-12-7(11)6(10)5-2-8-4-9-3-5/h2-4,6,10H,1H3
InChI Key:
GQONMURQTNGONL-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cncnc1)O
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties