CAS 23692-08-2 | 2-Piperidineacetic acid, methyl ester | CAS Number 23692-08-2

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23692-08-2 | 2-Piperidineacetic acid, methyl ester

CAS No: 23692-08-2 Catalog No: AG002O5V MDL No:MFCD09971805

Product Description

Catalog Number:

AG002O5V

Chemical Name:

2-Piperidineacetic acid, methyl ester

CAS Number:

23692-08-2

Molecular Formula:

C8H15NO2

Molecular Weight:

157.2102

MDL Number:

MFCD09971805

IUPAC Name:

methyl 2-piperidin-2-ylacetate

InChI:

InChI=1S/C8H15NO2/c1-11-8(10)6-7-4-2-3-5-9-7/h7,9H,2-6H2,1H3

InChI Key:

KNLRJTRKAHPHEE-UHFFFAOYSA-N

SMILES:

COC(=O)CC1CCCCN1

Properties

Complexity:

136

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

157.11g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

157.213g/mol

Monoisotopic Mass:

157.11g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5

Literature

Title	Journal
Synthesis of the quinolizidine alkaloids (-)-lasubine II and (+/-)-myrtine by conjugate addition and intramolecular acylation of amino esters with acetylenic sulfones.	The Journal of organic chemistry 20050204
Total Synthesis of (-)-lasubine II by the conjugate addition and intramolecular acylation of an amino ester with an acetylenic sulfone.	Organic letters 20020516