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1095010-47-1 | 1-tert-Butyl 3-methyl 5-hydroxypiperidine-1,3-dicarboxylate
CAS No: 1095010-47-1 Catalog No: AG00355E MDL No:MFCD11656770
Product Description
Catalog Number:
AG00355E
Chemical Name:
1-tert-Butyl 3-methyl 5-hydroxypiperidine-1,3-dicarboxylate
CAS Number:
1095010-47-1
Molecular Formula:
C12H21NO5
Molecular Weight:
259.2988
MDL Number:
MFCD11656770
IUPAC Name:
1-O-tert-butyl 3-O-methyl 5-hydroxypiperidine-1,3-dicarboxylate
InChI:
InChI=1S/C12H21NO5/c1-12(2,3)18-11(16)13-6-8(10(15)17-4)5-9(14)7-13/h8-9,14H,5-7H2,1-4H3
InChI Key:
DFZMPKMSTNKZKL-UHFFFAOYSA-N
SMILES:
COC(=O)C1CC(O)CN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
323
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:
1
Isotope Atom Count:
0
Molecular Weight:
259.302g/mol
Monoisotopic Mass:
259.142g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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