200,000+ products from a single source!
sales@angenechem.com
100911-43-1 | 4-Oxazolidinecarboxylic acid, 4,5,5-trimethyl-2-oxo-
CAS No: 100911-43-1 Catalog No: AG00036Y MDL No:
Product Description
Catalog Number:
AG00036Y
Chemical Name:
4-Oxazolidinecarboxylic acid, 4,5,5-trimethyl-2-oxo-
CAS Number:
100911-43-1
Molecular Formula:
C7H11NO4
Molecular Weight:
173.1665
IUPAC Name:
4,5,5-trimethyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
InChI:
InChI=1S/C7H11NO4/c1-6(2)7(3,4(9)10)8-5(11)12-6/h1-3H3,(H,8,11)(H,9,10)
InChI Key:
BKOFVIOQDMUGPU-UHFFFAOYSA-N
SMILES:
O=C1NC(C(O1)(C)C)(C)C(=O)O
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.168g/mol
Monoisotopic Mass:
173.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.