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(S)-2-(4,5-Dihydro-4-isopropyl-2-oxazolyl)quinoline

(S)-2-(4,5-Dihydro-4-isopropyl-2-oxazolyl)quinoline

Inquiry

Molecular Formula:

C15H16N2O

Molecular Weight:

240.30

CAS Number:

226387-11-7

Catalog Number:

226387-11-7

Product Information

Molecular Formula:

C15H16N2O

Molecular Weight:

240.30

Description

(S)-2-(4,5-Dihydro-4-isopropyl-2-oxazolyl)quinoline is a chiral nitrogen ligand for enantioselective synthesis.

Synonyms

(S)-i-PrQuinox

IUPAC Name

(4S)-4-propan-2-yl-2-quinolin-2-yl-4,5-dihydro-1,3-oxazole

Canonical SMILES

CC(C)[C@H]1COC(=N1)c2ccc3ccccc3n2

InChI

InChI=1S/C15H16N2O/c1-10(2)14-9-18-15(17-14)13-8-7-11-5-3-4-6-12(11)16-13/h3-8,10,14H,9H2,1-2H3/t14-/m1/s1

InChI Key

CCXYFOHSQUOJAN-CQSZACIVSA-N

Melting Point

75-80 °C

Flash Point

Not applicable

Purity

97%

Storage

Inert atmosphere. Keep cold.

Safety Information

Hazards

H315 - H319

Precautionary Statement

P302 + P352 - P305 + P351 + P338

Signal Word

Warning

Computed Properties

XLogP3

3.4

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

240.126263138 g/mol

Monoisotopic Mass

240.126263138 g/mol

Topological Polar Surface Area

34.5Å²

Heavy Atom Count

Formal Charge

Complexity

327

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
AU-2015274967-A1	Processes for preparing antiviral compounds	2014-06-11
CN-106488920-A	The preparation method of antiviral compound	2014-06-11
EP-3154984-B1	Processes for preparing antiviral compounds	2014-06-11
ES-2690868-T3	Processes to prepare antiviral compounds	2014-06-11
JP-2017517541-A	Process for preparing antiviral compounds	2014-06-11
JP-2018052985-A	Process for preparing antiviral compounds	2014-06-11
JP-2019178179-A	Process for preparing antiviral compounds	2014-06-11
JP-6295348-B2	Process for preparing antiviral compounds	2014-06-11
KR-101908642-B1	Processes for preparing antiviral compounds	2014-06-11
KR-20170015493-A	Processes for preparing antiviral compounds	2014-06-11

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