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89248-81-7 | 4-Oxazolidineheptanoic acid, 2-oxo-, methyl ester
CAS No: 89248-81-7 Catalog No: AG0042GT MDL No:
Product Description
Catalog Number:
AG0042GT
Chemical Name:
4-Oxazolidineheptanoic acid, 2-oxo-, methyl ester
CAS Number:
89248-81-7
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
IUPAC Name:
methyl 7-(2-oxo-1,3-oxazolidin-4-yl)heptanoate
InChI:
InChI=1S/C11H19NO4/c1-15-10(13)7-5-3-2-4-6-9-8-16-11(14)12-9/h9H,2-8H2,1H3,(H,12,14)
InChI Key:
VIGNJZOYTARCMM-UHFFFAOYSA-N
SMILES:
COC(=O)CCCCCCC1COC(=O)N1
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
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:
1
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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