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1257856-87-3 | 4-Morpholinecarboxylic acid, 3-(2-oxoethyl)-, 1,1-dimethylethyl ester, (3R)-
CAS No: 1257856-87-3 Catalog No: AG000OQS MDL No:MFCD17010139
Product Description
Catalog Number:
AG000OQS
Chemical Name:
4-Morpholinecarboxylic acid, 3-(2-oxoethyl)-, 1,1-dimethylethyl ester, (3R)-
CAS Number:
1257856-87-3
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
MDL Number:
MFCD17010139
IUPAC Name:
tert-butyl (3R)-3-(2-oxoethyl)morpholine-4-carboxylate
InChI:
InChI=1S/C11H19NO4/c1-11(2,3)16-10(14)12-5-7-15-8-9(12)4-6-13/h6,9H,4-5,7-8H2,1-3H3/t9-/m1/s1
InChI Key:
KAKZEJFXZCXYMP-SECBINFHSA-N
SMILES:
O=CC[C@@H]1COCCN1C(=O)OC(C)(C)C
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
229.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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