CAS 1006-64-0 | Pyrrolidine, 2-phenyl- | CAS Number 1006-64-0

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1006-64-0 | Pyrrolidine, 2-phenyl-

CAS No: 1006-64-0 Catalog No: AG0002FU MDL No:MFCD01631835

Product Description

Catalog Number:

AG0002FU

Chemical Name:

Pyrrolidine, 2-phenyl-

CAS Number:

1006-64-0

Molecular Formula:

C10H13N

Molecular Weight:

147.2169

MDL Number:

MFCD01631835

IUPAC Name:

2-phenylpyrrolidine

InChI:

InChI=1S/C10H13N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6,10-11H,4,7-8H2

InChI Key:

JUTDHSGANMHVIC-UHFFFAOYSA-N

SMILES:

C1CNC(C1)c1ccccc1

NSC Number:

94961

Properties

Complexity:

116

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

147.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

147.221g/mol

Monoisotopic Mass:

147.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

12A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Highly effective asymmetric hydrogenation of cyclic N-alkyl imines with chiral cationic Ru-MsDPEN catalysts.	Organic letters 20110819
[Regioselectivity in the dehydrogenation of substituted ethylenediamines as nicotine models].	Die Pharmazie 20090901
A spectroscopic study of nicotine analogue 2-phenylpyrrolidine (PPD) using resonant two-photon ionization (R2PI), microwave, and 2D NMR techniques.	Journal of the American Chemical Society 20090225
Determination of the natural abundance delta15N of nicotine and related alkaloids by gas chromatography/isotope ratio mass spectrometry.	Rapid communications in mass spectrometry : RCM 20050101
1,2,5-Substituted derivatives of 2-phenylpyrrolidine.	Acta crystallographica. Section C, Crystal structure communications 20040601
Asymmetric alkyldifluoroboranes and their use in secondary amine synthesis.	Organic letters 20020627