Home Carboxys 2-[(tert-butoxy)methyl]-4-methyl-1,3-oxazole-5-carboxylic acid

2-[(tert-butoxy)methyl]-4-methyl-1,3-oxazole-5-carboxylic acid

CAS No.:
1565112-25-5
Catalog Number:
AG01B9GP
Molecular Formula:
C10H15NO4
Molecular Weight:
213.2304
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Product Description
Catalog Number:
AG01B9GP
Chemical Name:
2-[(tert-butoxy)methyl]-4-methyl-1,3-oxazole-5-carboxylic acid
CAS Number:
1565112-25-5
Molecular Formula:
C10H15NO4
Molecular Weight:
213.2304
MDL Number:
MFCD26055159
IUPAC Name:
4-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-1,3-oxazole-5-carboxylic acid
InChI:
InChI=1S/C10H15NO4/c1-6-8(9(12)13)15-7(11-6)5-14-10(2,3)4/h5H2,1-4H3,(H,12,13)
InChI Key:
CAOSWUHZWWHTRP-UHFFFAOYSA-N
SMILES:
OC(=O)c1oc(nc1C)COC(C)(C)C
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.1g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.233g/mol
Monoisotopic Mass:
213.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties