Home Other Building Blocks methyl 3-(5-hydroxy-3-methyl-1,2-oxazol-4-yl)propanoate

methyl 3-(5-hydroxy-3-methyl-1,2-oxazol-4-yl)propanoate

CAS No.:
1797797-59-1
Catalog Number:
AG01AFSF
Molecular Formula:
C8H11NO4
Molecular Weight:
185.1772
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Product Description
Catalog Number:
AG01AFSF
Chemical Name:
methyl 3-(5-hydroxy-3-methyl-1,2-oxazol-4-yl)propanoate
CAS Number:
1797797-59-1
Molecular Formula:
C8H11NO4
Molecular Weight:
185.1772
MDL Number:
MFCD27959364
IUPAC Name:
methyl 3-(3-methyl-5-oxo-2H-1,2-oxazol-4-yl)propanoate
InChI:
InChI=1S/C8H11NO4/c1-5-6(8(11)13-9-5)3-4-7(10)12-2/h9H,3-4H2,1-2H3
InChI Key:
HFCKRMCAMCALNK-UHFFFAOYSA-N
SMILES:
COC(=O)CCc1c(O)onc1C
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.179g/mol
Monoisotopic Mass:
185.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties