CAS 127986-84-9 | 2-Pyrrolidinemethanol, α,α-di-2-naphthalenyl-, (2S)- | CAS Number 127986-84-9

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127986-84-9 | 2-Pyrrolidinemethanol, α,α-di-2-naphthalenyl-, (2S)-

CAS No: 127986-84-9 Catalog No: AG000XNJ MDL No:MFCD00269672

Product Description

Catalog Number:

AG000XNJ

Chemical Name:

2-Pyrrolidinemethanol, α,α-di-2-naphthalenyl-, (2S)-

CAS Number:

127986-84-9

Molecular Formula:

C25H23NO

Molecular Weight:

353.4562

MDL Number:

MFCD00269672

IUPAC Name:

dinaphthalen-2-yl-[(2S)-pyrrolidin-2-yl]methanol

InChI:

InChI=1S/C25H23NO/c27-25(24-10-5-15-26-24,22-13-11-18-6-1-3-8-20(18)16-22)23-14-12-19-7-2-4-9-21(19)17-23/h1-4,6-9,11-14,16-17,24,26-27H,5,10,15H2/t24-/m0/s1

InChI Key:

LNUDNNFEXRHHGY-DEOSSOPVSA-N

SMILES:

OC(c1ccc2c(c1)cccc2)(c1ccc2c(c1)cccc2)[C@@H]1CCCN1

Properties

Complexity:

471

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

353.178g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

353.465g/mol

Monoisotopic Mass:

353.178g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

32.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.2

Literature

Title	Journal
(S)-(-)-alpha,alpha-Di(2-naphthyl)-2-pyrrolidinemethanol, a useful tool to study the recognition mechanism in chiral ligand-exchange chromatography.	Journal of separation science 20070101