200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1268474-69-6
1268474-69-6 | 3-Morpholinecarboxylic acid, 2-methyl-5-oxo-4-(phenylmethyl)-, (2S,3R)-
CAS No: 1268474-69-6 Catalog No: AG000TBU MDL No:MFCD28968120
Product Description
Catalog Number:
AG000TBU
Chemical Name:
3-Morpholinecarboxylic acid, 2-methyl-5-oxo-4-(phenylmethyl)-, (2S,3R)-
CAS Number:
1268474-69-6
Molecular Formula:
C13H15NO4
Molecular Weight:
249.2625
MDL Number:
MFCD28968120
IUPAC Name:
(2S,3R)-4-benzyl-2-methyl-5-oxomorpholine-3-carboxylic acid
InChI:
InChI=1S/C13H15NO4/c1-9-12(13(16)17)14(11(15)8-18-9)7-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3,(H,16,17)/t9-,12+/m0/s1
InChI Key:
UWKSAFKXCAKKDJ-JOYOIKCWSA-N
SMILES:
C[C@@H]1OCC(=O)N([C@H]1C(=O)O)Cc1ccccc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
249.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.266g/mol
Monoisotopic Mass:
249.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.