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1447240-83-6 | 3,4-Morpholinedicarboxylic acid, 3-methyl-, 4-(1,1-dimethylethyl) 3-methyl ester
CAS No: 1447240-83-6 Catalog No: AG001K2Q MDL No:MFCD25292791
Product Description
Catalog Number:
AG001K2Q
Chemical Name:
3,4-Morpholinedicarboxylic acid, 3-methyl-, 4-(1,1-dimethylethyl) 3-methyl ester
CAS Number:
1447240-83-6
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
MDL Number:
MFCD25292791
IUPAC Name:
4-O-tert-butyl 3-O-methyl 3-methylmorpholine-3,4-dicarboxylate
InChI:
InChI=1S/C12H21NO5/c1-11(2,3)18-10(15)13-6-7-17-8-12(13,4)9(14)16-5/h6-8H2,1-5H3
InChI Key:
NAPZVCIFIQJJOJ-UHFFFAOYSA-N
SMILES:
COC(=O)C1(C)COCCN1C(=O)OC(C)(C)C
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.302g/mol
Monoisotopic Mass:
259.142g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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