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886502-29-0 | 4-(4-Oxo-oxazolidin-3-yl)-butyric acid
CAS No: 886502-29-0 Catalog No: AG01EYEV MDL No:
Product Description
Catalog Number:
AG01EYEV
Chemical Name:
4-(4-Oxo-oxazolidin-3-yl)-butyric acid
CAS Number:
886502-29-0
Molecular Formula:
C7H11NO4
Molecular Weight:
173.1665
IUPAC Name:
4-(4-oxo-1,3-oxazolidin-3-yl)butanoic acid
InChI:
InChI=1S/C7H11NO4/c9-6-4-12-5-8(6)3-1-2-7(10)11/h1-5H2,(H,10,11)
InChI Key:
QDXLCKMNEWYMDQ-UHFFFAOYSA-N
SMILES:
OC(=O)CCCN1COCC1=O
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.168g/mol
Monoisotopic Mass:
173.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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