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1260641-46-0 | 1,2-PIPERIDINEDICARBOXYLIC ACID, 5-OXO-, 1-(1,1-DIMETHYLETHYL) ESTER
CAS No: 1260641-46-0 Catalog No: AG000QXL MDL No:
Product Description
Catalog Number:
AG000QXL
Chemical Name:
1,2-PIPERIDINEDICARBOXYLIC ACID, 5-OXO-, 1-(1,1-DIMETHYLETHYL) ESTER
CAS Number:
1260641-46-0
Molecular Formula:
C11H16NO5-
Molecular Weight:
242.2484
IUPAC Name:
1-[(2-methylpropan-2-yl)oxycarbonyl]-5-oxopiperidine-2-carboxylic acid
InChI:
InChI=1S/C11H17NO5/c1-11(2,3)17-10(16)12-6-7(13)4-5-8(12)9(14)15/h8H,4-6H2,1-3H3,(H,14,15)
InChI Key:
NYIZAJLUNOQXFW-UHFFFAOYSA-N
SMILES:
O=C1CCC(N(C1)C(=O)OC(C)(C)C)C(=O)[O-]
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.259g/mol
Monoisotopic Mass:
243.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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