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127589-93-9 | 3-Oxazolidinecarboxylic acid, 4-formyl-2,2-dimethyl-, 1,1-dimethylethyl ester
CAS No: 127589-93-9 Catalog No: AG000X6H MDL No:MFCD04221008
Product Description
Catalog Number:
AG000X6H
Chemical Name:
3-Oxazolidinecarboxylic acid, 4-formyl-2,2-dimethyl-, 1,1-dimethylethyl ester
CAS Number:
127589-93-9
Molecular Formula:
C11H19NO4
Molecular Weight:
229.2729
MDL Number:
MFCD04221008
IUPAC Name:
tert-butyl 4-formyl-2,2-dimethyl-1,3-oxazolidine-3-carboxylate
InChI:
InChI=1S/C11H19NO4/c1-10(2,3)16-9(14)12-8(6-13)7-15-11(12,4)5/h6,8H,7H2,1-5H3
InChI Key:
PNJXYVJNOCLJLJ-UHFFFAOYSA-N
SMILES:
O=CC1COC(N1C(=O)OC(C)(C)C)(C)C
Properties
Complexity:
293
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:
0
Isotope Atom Count:
0
Molecular Weight:
229.276g/mol
Monoisotopic Mass:
229.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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