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1676-88-6 | 4-Oxazolidinepropanoic acid, 2,5-dioxo-, methyl ester, (R)- (9CI)
CAS No: 1676-88-6 Catalog No: AG001XHR MDL No:
Product Description
Catalog Number:
AG001XHR
Chemical Name:
4-Oxazolidinepropanoic acid, 2,5-dioxo-, methyl ester, (R)- (9CI)
CAS Number:
1676-88-6
Molecular Formula:
C7H9NO5
Molecular Weight:
187.1501
IUPAC Name:
methyl 3-(2,5-dioxo-1,3-oxazolidin-4-yl)propanoate
InChI:
InChI=1S/C7H9NO5/c1-12-5(9)3-2-4-6(10)13-7(11)8-4/h4H,2-3H2,1H3,(H,8,11)
InChI Key:
JRZZMWDRALHNFH-UHFFFAOYSA-N
SMILES:
COC(=O)CC[C@H]1NC(=O)OC1=O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.151g/mol
Monoisotopic Mass:
187.048g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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