(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine

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CAS
131864-67-0
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Catalog Number

ACM131864670-1

Product Name

(R,R)-2,6-Bis(4-isopropyl-2-oxazolin-2-yl)pyridine

Structure

CAS

131864-67-0

Category

Heterocyclic Organic Compound

Synonyms

(R,R)-i-Pr-pybox

IUPAC Name

(4R)-4-propan-2-yl-2-[6-[(4R)-4-propan-2-yl-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole

Molecular Weight

301.38

Molecular Formula

C17H23N3O2

Canonical SMILES

CC(C)C1COC(=N1)C2=NC(=CC=C2)C3=NC(CO3)C(C)C

InChI

CSGQGLBCAHGJDR-GJZGRUSLSA-N

InChI Key

InChI=1S/C17H23N3O2/c1-10(2)14-8-21-16(19-14)12-6-5-7-13(18-12)17-20-15(9-22-17)11(3)4/h5-7,10-11,14-15H,8-9H2,1-4H3/t14-,15-/m0/s1

Boiling Point

457.1±30.0 °C(Predicted)

Melting Point

154-156 °C-lit.

Appearance

White crystalline

Complexity

419

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Exact Mass

301.17902698

H-Bond Acceptor

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isomeric SMILES

CC(C)[C@@H]1COC(=N1)C2=NC(=CC=C2)C3=N[C@@H](CO3)C(C)C

Monoisotopic Mass

301.17902698

Rotatable Bond Count

Topological Polar Surface Area

56.1 Å²

UNII

7JMD4LB64Z

MSDS

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COA

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Spec Sheet

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