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89248-99-7 | 4-Oxazolidineheptanoic acid, 2-oxo-3-(3-oxooctyl)-, methyl ester
CAS No: 89248-99-7 Catalog No: AG00425S MDL No:
Product Description
Catalog Number:
AG00425S
Chemical Name:
4-Oxazolidineheptanoic acid, 2-oxo-3-(3-oxooctyl)-, methyl ester
CAS Number:
89248-99-7
Molecular Formula:
C19H33NO5
Molecular Weight:
355.4690
IUPAC Name:
methyl 7-[2-oxo-3-(3-oxooctyl)-1,3-oxazolidin-4-yl]heptanoate
InChI:
InChI=1S/C19H33NO5/c1-3-4-7-11-17(21)13-14-20-16(15-25-19(20)23)10-8-5-6-9-12-18(22)24-2/h16H,3-15H2,1-2H3
InChI Key:
FTSQNBLMSVQARZ-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)CCN1C(CCCCCCC(=O)OC)COC1=O
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
355.236g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.475g/mol
Monoisotopic Mass:
355.236g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
72.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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