CAS 60835-71-4 4'-Aminobenzo-15-crown 5-Ether

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4'-Aminobenzo-15-crown 5-Ether

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Catalog Number

ACM60835714-1

CAS Number

60835-71-4

Product Name

4'-Aminobenzo-15-crown 5-Ether

Structure

Category

Macrocycles; Supramolecular Host Materials

IUPAC Name

2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-amine

Molecular Weight

283.32g/mol

Molecular Formula

C14H21NO5

Canonical SMILES

C1COCCOC2=C(C=C(C=C2)N)OCCOCCO1

InChI

InChI=1S/C14H21NO5/c15-12-1-2-13-14(11-12)20-10-8-18-6-4-16-3-5-17-7-9-19-13/h1-2,11H,3-10,15H2

InChI Key

CQNGAZMLFIMLQN-UHFFFAOYSA-N

Complexity

254

Covalently-Bonded Unit Count

Exact Mass

283.141973g/mol

Formal Charge

Heavy Atom Count

MeSH Entry Terms

4'-aminobenzo-15-crown-5

Monoisotopic Mass

283.141973g/mol

Rotatable Bond Count

XLogP3

-0.3

MSDS

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COA

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Spec Sheet

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