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869189-69-5 | Dimethyl piperidine-1,4-dicarboxylate
CAS No: 869189-69-5 Catalog No: AG004LA8 MDL No:
Product Description
Catalog Number:
AG004LA8
Chemical Name:
Dimethyl piperidine-1,4-dicarboxylate
CAS Number:
869189-69-5
Molecular Formula:
C9H15NO4
Molecular Weight:
201.2197
IUPAC Name:
dimethyl piperidine-1,4-dicarboxylate
InChI:
InChI=1S/C9H15NO4/c1-13-8(11)7-3-5-10(6-4-7)9(12)14-2/h7H,3-6H2,1-2H3
InChI Key:
HMSXPKTWOSJFEN-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCN(CC1)C(=O)OC
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.222g/mol
Monoisotopic Mass:
201.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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