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

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

CAS No.:
1248499-31-1
Catalog Number:
AG01ACUW
Molecular Formula:
C9H13NO4
Molecular Weight:
199.2038
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ACUW
Chemical Name:
5-[(tert-butoxy)methyl]-1,2-oxazole-3-carboxylic acid
CAS Number:
1248499-31-1
Molecular Formula:
C9H13NO4
Molecular Weight:
199.2038
MDL Number:
MFCD14658821
IUPAC Name:
5-[(2-methylpropan-2-yl)oxymethyl]-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C9H13NO4/c1-9(2,3)13-5-6-4-7(8(11)12)10-14-6/h4H,5H2,1-3H3,(H,11,12)
InChI Key:
QFGJEOMHKLFVDN-UHFFFAOYSA-N
SMILES:
OC(=O)c1noc(c1)COC(C)(C)C
Properties
Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.206g/mol
Monoisotopic Mass:
199.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties