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45895-88-3 | (4S)-4-(sec-Butyl)oxazolidine-2,5-dione
CAS No: 45895-88-3 Catalog No: AG003CM9 MDL No:
Product Description
Catalog Number:
AG003CM9
Chemical Name:
(4S)-4-(sec-Butyl)oxazolidine-2,5-dione
CAS Number:
45895-88-3
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
IUPAC Name:
(4S)-4-butan-2-yl-1,3-oxazolidine-2,5-dione
InChI:
InChI=1S/C7H11NO3/c1-3-4(2)5-6(9)11-7(10)8-5/h4-5H,3H2,1-2H3,(H,8,10)/t4?,5-/m0/s1
InChI Key:
WAACGCAWLJFFQX-AKGZTFGVSA-N
SMILES:
CC([C@@H]1NC(=O)OC1=O)CC
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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